Diff of the two buildlogs: -- --- b1/build.log 2024-01-07 18:02:52.734282510 +0000 +++ b2/build.log 2024-01-07 20:20:15.491868985 +0000 @@ -1,6 +1,6 @@ I: pbuilder: network access will be disabled during build -I: Current time: Sun Jan 7 03:29:23 -12 2024 -I: pbuilder-time-stamp: 1704641363 +I: Current time: Sun Feb 9 14:26:02 +14 2025 +I: pbuilder-time-stamp: 1739060762 I: Building the build Environment I: extracting base tarball [/var/cache/pbuilder/bullseye-reproducible-base.tgz] I: copying local configuration @@ -17,7 +17,7 @@ I: copying [./cp2k_8.1-9.debian.tar.xz] I: Extracting source gpgv: unknown type of key resource 'trustedkeys.kbx' -gpgv: keyblock resource '/tmp/dpkg-verify-sig.KgllkWtA/trustedkeys.kbx': General error +gpgv: keyblock resource '/tmp/dpkg-verify-sig.CIQoaIMB/trustedkeys.kbx': General error gpgv: Signature made Tue Mar 23 08:04:41 2021 gpgv: using RSA key 9CA877749FAB2E4FA96862ECDC686A27B43481B0 gpgv: Can't check signature: No public key @@ -30,49 +30,80 @@ dpkg-source: info: applying testsuite_output.patch I: Not using root during the build. I: Installing the build-deps -I: user script /srv/workspace/pbuilder/3750649/tmp/hooks/D02_print_environment starting +I: user script /srv/workspace/pbuilder/773568/tmp/hooks/D01_modify_environment starting +debug: Running on ionos15-amd64. +I: Changing host+domainname to test build reproducibility +I: Adding a custom variable just for the fun of it... +I: Changing /bin/sh to bash +'/bin/sh' -> '/bin/bash' +lrwxrwxrwx 1 root root 9 Feb 9 00:26 /bin/sh -> /bin/bash +I: Setting pbuilder2's login shell to /bin/bash +I: Setting pbuilder2's GECOS to second user,second room,second work-phone,second home-phone,second other +I: user script /srv/workspace/pbuilder/773568/tmp/hooks/D01_modify_environment finished +I: user script /srv/workspace/pbuilder/773568/tmp/hooks/D02_print_environment starting I: set - BUILDDIR='/build/reproducible-path' - BUILDUSERGECOS='first user,first room,first work-phone,first home-phone,first other' - BUILDUSERNAME='pbuilder1' - BUILD_ARCH='amd64' - DEBIAN_FRONTEND='noninteractive' - DEB_BUILD_OPTIONS='buildinfo=+all reproducible=+all,-fixfilepath parallel=15 ' - DISTRIBUTION='bullseye' - HOME='/root' - HOST_ARCH='amd64' + BASH=/bin/sh + BASHOPTS=checkwinsize:cmdhist:complete_fullquote:extquote:force_fignore:globasciiranges:hostcomplete:interactive_comments:progcomp:promptvars:sourcepath + BASH_ALIASES=() + BASH_ARGC=() + BASH_ARGV=() + BASH_CMDS=() + BASH_LINENO=([0]="12" [1]="0") + BASH_SOURCE=([0]="/tmp/hooks/D02_print_environment" [1]="/tmp/hooks/D02_print_environment") + BASH_VERSINFO=([0]="5" [1]="1" [2]="4" [3]="1" [4]="release" [5]="x86_64-pc-linux-gnu") + BASH_VERSION='5.1.4(1)-release' + BUILDDIR=/build/reproducible-path + BUILDUSERGECOS='second user,second room,second work-phone,second home-phone,second other' + BUILDUSERNAME=pbuilder2 + BUILD_ARCH=amd64 + DEBIAN_FRONTEND=noninteractive + DEB_BUILD_OPTIONS='buildinfo=+all reproducible=+all,-fixfilepath parallel=16 ' + DIRSTACK=() + DISTRIBUTION=bullseye + EUID=0 + FUNCNAME=([0]="Echo" [1]="main") + GROUPS=() + HOME=/root + HOSTNAME=i-capture-the-hostname + HOSTTYPE=x86_64 + HOST_ARCH=amd64 IFS=' ' - INVOCATION_ID='66eeaf5e06d24db9872ac773544a46d0' - LANG='C' - LANGUAGE='en_US:en' - LC_ALL='C' - MAIL='/var/mail/root' - OPTIND='1' - PATH='/usr/sbin:/usr/bin:/sbin:/bin:/usr/games' - PBCURRENTCOMMANDLINEOPERATION='build' - PBUILDER_OPERATION='build' - PBUILDER_PKGDATADIR='/usr/share/pbuilder' - PBUILDER_PKGLIBDIR='/usr/lib/pbuilder' - PBUILDER_SYSCONFDIR='/etc' - PPID='3750649' - PS1='# ' - PS2='> ' + INVOCATION_ID=fcb4195856dc405a91f56ec44243f559 + LANG=C + LANGUAGE=et_EE:et + LC_ALL=C + MACHTYPE=x86_64-pc-linux-gnu + MAIL=/var/mail/root + OPTERR=1 + OPTIND=1 + OSTYPE=linux-gnu + PATH=/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path + PBCURRENTCOMMANDLINEOPERATION=build + PBUILDER_OPERATION=build + PBUILDER_PKGDATADIR=/usr/share/pbuilder + PBUILDER_PKGLIBDIR=/usr/lib/pbuilder + PBUILDER_SYSCONFDIR=/etc + PIPESTATUS=([0]="0") + POSIXLY_CORRECT=y + PPID=773568 PS4='+ ' - PWD='/' - SHELL='/bin/bash' - SHLVL='2' - SUDO_COMMAND='/usr/bin/timeout -k 18.1h 18h /usr/bin/ionice -c 3 /usr/bin/nice /usr/sbin/pbuilder --build --configfile /srv/reproducible-results/rbuild-debian/r-b-build.8C9nOi2l/pbuilderrc_xkQI --distribution bullseye --hookdir /etc/pbuilder/first-build-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/bullseye-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.8C9nOi2l/b1 --logfile b1/build.log cp2k_8.1-9.dsc' - SUDO_GID='111' - SUDO_UID='106' - SUDO_USER='jenkins' - TERM='unknown' - TZ='/usr/share/zoneinfo/Etc/GMT+12' - USER='root' - _='/usr/bin/systemd-run' - http_proxy='http://78.137.99.97:3128' + PWD=/ + SHELL=/bin/bash + SHELLOPTS=braceexpand:errexit:hashall:interactive-comments:posix + SHLVL=3 + SUDO_COMMAND='/usr/bin/timeout -k 24.1h 24h /usr/bin/ionice -c 3 /usr/bin/nice -n 11 /usr/bin/unshare --uts -- /usr/sbin/pbuilder --build --configfile /srv/reproducible-results/rbuild-debian/r-b-build.8C9nOi2l/pbuilderrc_JOJW --distribution bullseye --hookdir /etc/pbuilder/rebuild-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/bullseye-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.8C9nOi2l/b2 --logfile b2/build.log cp2k_8.1-9.dsc' + SUDO_GID=111 + SUDO_UID=106 + SUDO_USER=jenkins + TERM=unknown + TZ=/usr/share/zoneinfo/Etc/GMT-14 + UID=0 + USER=root + _='I: set' + http_proxy=http://85.184.249.68:3128 I: uname -a - Linux ionos11-amd64 6.1.0-17-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.1.69-1 (2023-12-30) x86_64 GNU/Linux + Linux i-capture-the-hostname 6.5.0-0.deb12.4-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.5.10-1~bpo12+1 (2023-11-23) x86_64 GNU/Linux I: ls -l /bin total 5476 -rwxr-xr-x 1 root root 1234376 Mar 27 2022 bash @@ -132,7 +163,7 @@ -rwxr-xr-x 1 root root 52032 Sep 24 2020 rmdir -rwxr-xr-x 1 root root 27472 Sep 27 2020 run-parts -rwxr-xr-x 1 root root 122224 Dec 22 2018 sed - lrwxrwxrwx 1 root root 4 Jan 7 09:25 sh -> dash + lrwxrwxrwx 1 root root 9 Feb 9 00:26 sh -> /bin/bash -rwxr-xr-x 1 root root 43808 Sep 24 2020 sleep -rwxr-xr-x 1 root root 84928 Sep 24 2020 stty -rwsr-xr-x 1 root root 71912 Jan 20 2022 su @@ -158,7 +189,7 @@ -rwxr-xr-x 1 root root 2206 Apr 10 2022 zless -rwxr-xr-x 1 root root 1842 Apr 10 2022 zmore -rwxr-xr-x 1 root root 4577 Apr 10 2022 znew -I: user script /srv/workspace/pbuilder/3750649/tmp/hooks/D02_print_environment finished +I: user script /srv/workspace/pbuilder/773568/tmp/hooks/D02_print_environment finished -> Attempting to satisfy build-dependencies -> Creating pbuilder-satisfydepends-dummy package Package: pbuilder-satisfydepends-dummy @@ -389,7 +420,7 @@ Get: 159 http://deb.debian.org/debian bullseye/main amd64 libxc5 amd64 4.3.4-2 [2001 kB] Get: 160 http://deb.debian.org/debian bullseye/main amd64 libxc-dev amd64 4.3.4-2 [3633 kB] Get: 161 http://deb.debian.org/debian bullseye/main amd64 pkg-config amd64 0.29.2-1 [65.1 kB] -Fetched 147 MB in 39s (3747 kB/s) +Fetched 147 MB in 2s (85.6 MB/s) debconf: delaying package configuration, since apt-utils is not installed Selecting previously unselected package bsdextrautils. (Reading database ... (Reading database ... 5% (Reading database ... 10% (Reading database ... 15% (Reading database ... 20% (Reading database ... 25% (Reading database ... 30% (Reading database ... 35% (Reading database ... 40% (Reading database ... 45% (Reading database ... 50% (Reading database ... 55% (Reading database ... 60% (Reading database ... 65% (Reading database ... 70% (Reading database ... 75% (Reading database ... 80% (Reading database ... 85% (Reading database ... 90% (Reading database ... 95% (Reading database ... 100% (Reading database ... 17743 files and directories currently installed.) @@ -908,8 +939,8 @@ Setting up tzdata (2021a-1+deb11u10) ... Current default time zone: 'Etc/UTC' -Local time is now: Sun Jan 7 15:31:42 UTC 2024. -Universal Time is now: Sun Jan 7 15:31:42 UTC 2024. +Local time is now: Sun Feb 9 00:26:55 UTC 2025. +Universal Time is now: Sun Feb 9 00:26:55 UTC 2025. Run 'dpkg-reconfigure tzdata' if you wish to change it. Setting up libasound2-data (1.2.4-1.1) ... @@ -1218,7 +1249,11 @@ Building tag database... -> Finished parsing the build-deps I: Building the package -I: Running cd /build/reproducible-path/cp2k-8.1/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-buildpackage -us -uc -b && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-genchanges -S > ../cp2k_8.1-9_source.changes +I: user script /srv/workspace/pbuilder/773568/tmp/hooks/A99_set_merged_usr starting +Not re-configuring usrmerge for bullseye +I: user script /srv/workspace/pbuilder/773568/tmp/hooks/A99_set_merged_usr finished +hostname: Name or service not known +I: Running cd /build/reproducible-path/cp2k-8.1/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path" HOME="/nonexistent/second-build" dpkg-buildpackage -us -uc -b && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path" HOME="/nonexistent/second-build" dpkg-genchanges -S > ../cp2k_8.1-9_source.changes dpkg-buildpackage: info: source package cp2k dpkg-buildpackage: info: source version 8.1-9 dpkg-buildpackage: info: source distribution unstable @@ -1254,7 +1289,7 @@ rm -f arch/Linux-`uname -m`-gfortran.* rm -rf LAST* TEST* dh_auto_clean - make -j15 distclean + make -j16 distclean make[2]: Entering directory '/build/reproducible-path/cp2k-8.1' Discovering programs ... Makefile:408: target 'precommitclean' does not exist @@ -1374,165 +1409,165 @@ Warning: 'getpid' declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_machine_internal.mod' due to: dbcsr_machine_internal.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_internal.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine_posix.f90 dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_machine.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine.F dbcsr_machine_internal.mod dbcsr_kinds.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_machine.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine.F dbcsr_kinds.mod dbcsr_machine_internal.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine.F dbcsr_machine.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_machine.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_machine.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_machine.mod' due to: dbcsr_machine.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine.F dbcsr_machine_internal.mod dbcsr_kinds.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_machine.mod' due to: dbcsr_machine.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_machine.F dbcsr_kinds.mod dbcsr_machine_internal.mod true /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_base_hooks.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_hooks.F dbcsr_machine.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_hooks.F dbcsr_base_hooks.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_base_hooks.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_base_hooks.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_base_hooks.mod' due to: dbcsr_base_hooks.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_hooks.F dbcsr_machine.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_array_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_array_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_array_types.F dbcsr_array_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_array_types.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_array_types.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_array_types.mod' due to: dbcsr_array_types.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_array_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod -true /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_stream.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_stream.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_stream.F dbcsr_acc_stream.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_stream.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_stream.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_stream.mod' due to: dbcsr_acc_stream.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_stream.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_devmem.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_devmem.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_acc_stream.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_devmem.F dbcsr_acc_devmem.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_devmem.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_devmem.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_devmem.mod' due to: dbcsr_acc_devmem.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_devmem.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_acc_stream.mod -true /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_event.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_event.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_acc_stream.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_event.F dbcsr_acc_event.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_event.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_event.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_event.mod' due to: dbcsr_acc_event.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_event.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_acc_stream.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_data_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_event.mod dbcsr_acc_stream.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_devmem.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_devmem.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_acc_stream.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_devmem.F dbcsr_acc_devmem.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_devmem.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_devmem.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_devmem.mod' due to: dbcsr_acc_devmem.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_devmem.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_acc_stream.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_data_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_acc_event.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_acc_stream.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_types.F dbcsr_data_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_data_types.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_data_types.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_data_types.mod' due to: dbcsr_data_types.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_event.mod dbcsr_acc_stream.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_data_types.mod' due to: dbcsr_data_types.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_acc_event.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_acc_stream.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_array_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_array_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_array_types.F dbcsr_array_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_array_types.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_array_types.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_array_types.mod' due to: dbcsr_array_types.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_array_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod true /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_btree.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_btree.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_btree.fypp python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_btree.F dbcsr_btree.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_btree.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_btree.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_btree.mod' due to: dbcsr_btree.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_btree.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_btree.fypp true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_types.F dbcsr_array_types.mod dbcsr_data_types.mod dbcsr_kinds.mod dbcsr_btree.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_types.F dbcsr_data_types.mod dbcsr_array_types.mod dbcsr_kinds.mod dbcsr_btree.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_types.F dbcsr_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_types.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_types.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_types.mod' due to: dbcsr_types.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_types.F dbcsr_array_types.mod dbcsr_data_types.mod dbcsr_kinds.mod dbcsr_btree.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mpiwrap.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.fypp dbcsr_machine.mod dbcsr_kinds.mod dbcsr_base_hooks.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F dbcsr_mpiwrap.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mpiwrap.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mpiwrap.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mpiwrap.mod' due to: dbcsr_mpiwrap.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.fypp dbcsr_machine.mod dbcsr_kinds.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_types.mod' due to: dbcsr_types.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_types.F dbcsr_data_types.mod dbcsr_array_types.mod dbcsr_kinds.mod dbcsr_btree.mod true /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_hostmem.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_hostmem.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_acc_stream.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_hostmem.F dbcsr_acc_hostmem.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_hostmem.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_hostmem.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_hostmem.mod' due to: dbcsr_acc_hostmem.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_hostmem.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_acc_stream.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_ptr_util.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_ptr_util.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_mpiwrap.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_hostmem.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mpiwrap.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_machine.mod dbcsr_kinds.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F dbcsr_mpiwrap.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mpiwrap.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mpiwrap.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mpiwrap.mod' due to: dbcsr_mpiwrap.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mpiwrap.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_machine.mod dbcsr_kinds.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_ptr_util.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_ptr_util.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_base_hooks.mod dbcsr_acc_hostmem.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_ptr_util.F dbcsr_ptr_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_ptr_util.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_ptr_util.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_ptr_util.mod' due to: dbcsr_ptr_util.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_ptr_util.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_mpiwrap.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_hostmem.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_ptr_util.mod' due to: dbcsr_ptr_util.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_ptr_util.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_base_hooks.mod dbcsr_acc_hostmem.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod true /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_device.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_device.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_device.F dbcsr_acc_device.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_device.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_device.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_device.mod' due to: dbcsr_acc_device.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_device.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_config.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_config.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mpiwrap.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_ptr_util.mod dbcsr_acc_device.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_config.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_config.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_ptr_util.mod dbcsr_acc_device.mod dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_config.F dbcsr_config.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_config.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_config.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_config.mod' due to: dbcsr_config.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_config.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mpiwrap.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_ptr_util.mod dbcsr_acc_device.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_data_methods_low.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods_low.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_event.mod dbcsr_ptr_util.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods_low.F dbcsr_data_methods_low.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_data_methods_low.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_data_methods_low.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_data_methods_low.mod' due to: dbcsr_data_methods_low.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods_low.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_event.mod dbcsr_ptr_util.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_config.mod' due to: dbcsr_config.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_config.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_ptr_util.mod dbcsr_acc_device.mod dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_block_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_data_methods_low.mod dbcsr_base_hooks.mod dbcsr_ptr_util.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_operations.F dbcsr_block_operations.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_block_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_block_operations.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_operations.F:939:61: - - 939 | dst_sizes(1), dst_sizes(2)) - | ^ -Warning: 'src_ub[1]' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_block_operations.mod' due to: dbcsr_block_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_data_methods_low.mod dbcsr_base_hooks.mod dbcsr_ptr_util.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_min_heap.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_min_heap.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_kinds.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_min_heap.F dbcsr_min_heap.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_min_heap.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_min_heap.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_min_heap.mod' due to: dbcsr_min_heap.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_min_heap.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_kinds.mod true /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_array_sort.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_array_sort.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_array_sort.fypp dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_array_sort.F dbcsr_array_sort.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_array_sort.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_array_sort.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_array_sort.mod' due to: dbcsr_array_sort.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_array_sort.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_array_sort.fypp dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_toollib.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_toollib.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_array_sort.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_toollib.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_toollib.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_array_sort.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_toollib.F dbcsr_toollib.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_toollib.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_toollib.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_toollib.mod' due to: dbcsr_toollib.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_toollib.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_array_sort.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_toollib.mod' due to: dbcsr_toollib.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_toollib.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_array_sort.mod dbcsr_kinds.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_data_methods_low.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods_low.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_acc_event.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods_low.F dbcsr_data_methods_low.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_data_methods_low.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_data_methods_low.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_data_methods_low.mod' due to: dbcsr_data_methods_low.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods_low.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_acc_event.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mem_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_mem_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_kinds.mod dbcsr_data_methods_low.mod dbcsr_base_hooks.mod dbcsr_acc_stream.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mem_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_mem_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_acc_stream.mod dbcsr_data_methods_low.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_mem_methods.F dbcsr_mem_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mem_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mem_methods.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mem_methods.mod' due to: dbcsr_mem_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_mem_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_kinds.mod dbcsr_data_methods_low.mod dbcsr_base_hooks.mod dbcsr_acc_stream.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mem_methods.mod' due to: dbcsr_mem_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_mem_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_acc_stream.mod dbcsr_data_methods_low.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_data_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_data_methods_low.mod dbcsr_mem_methods.mod dbcsr_base_hooks.mod dbcsr_acc_event.mod dbcsr_ptr_util.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_data_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_acc_event.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_mem_methods.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_data_methods_low.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods.F dbcsr_data_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_data_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_data_methods.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_data_methods.mod' due to: dbcsr_data_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_data_methods_low.mod dbcsr_mem_methods.mod dbcsr_base_hooks.mod dbcsr_acc_event.mod dbcsr_ptr_util.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_data_methods.mod' due to: dbcsr_data_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_acc_event.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_mem_methods.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_data_methods_low.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_btree.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_ptr_util.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_btree.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_methods.F dbcsr_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_methods.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_methods.mod' due to: dbcsr_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_btree.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_ptr_util.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_methods.mod' due to: dbcsr_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_btree.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mp_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_base_hooks.mod dbcsr_methods.mod dbcsr_mpiwrap.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mp_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_methods.F dbcsr_mp_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mp_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mp_methods.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mp_methods.mod' due to: dbcsr_mp_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_base_hooks.mod dbcsr_methods.mod dbcsr_mpiwrap.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_min_heap.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_min_heap.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_min_heap.F dbcsr_min_heap.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_min_heap.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_min_heap.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_min_heap.mod' due to: dbcsr_min_heap.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_min_heap.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mp_methods.mod' due to: dbcsr_mp_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_mpiwrap.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_dist_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_mp_methods.mod dbcsr_kinds.mod dbcsr_min_heap.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_dist_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_config.mod dbcsr_min_heap.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_kinds.mod dbcsr_mp_methods.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_methods.F dbcsr_dist_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_dist_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_dist_methods.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_dist_methods.mod' due to: dbcsr_dist_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_mp_methods.mod dbcsr_kinds.mod dbcsr_min_heap.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_dist_methods.mod' due to: dbcsr_dist_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_config.mod dbcsr_min_heap.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_kinds.mod dbcsr_mp_methods.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_dist_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_min_heap.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_kinds.mod dbcsr_mp_methods.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_operations.F dbcsr_dist_operations.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_dist_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_dist_operations.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_dist_operations.mod' due to: dbcsr_dist_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_min_heap.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_kinds.mod dbcsr_mp_methods.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_index_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_index_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_dist_operations.mod dbcsr_config.mod dbcsr_ptr_util.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_kinds.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_index_operations.F dbcsr_index_operations.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_index_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_index_operations.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_index_operations.mod' due to: dbcsr_index_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_index_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_dist_operations.mod dbcsr_config.mod dbcsr_ptr_util.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_kinds.mod true /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_string_utilities.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_string_utilities.F dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_string_utilities.F dbcsr_string_utilities.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_string_utilities.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_string_utilities.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_string_utilities.mod' due to: dbcsr_string_utilities.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_string_utilities.F dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_iterator_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_iterator_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod dbcsr_methods.mod dbcsr_ptr_util.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_iterator_operations.F dbcsr_iterator_operations.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_iterator_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_iterator_operations.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_iterator_operations.mod' due to: dbcsr_iterator_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_iterator_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod dbcsr_methods.mod dbcsr_ptr_util.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_dist_util.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_util.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_dist_util.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_util.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_util.F dbcsr_dist_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_dist_util.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_dist_util.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_dist_util.mod' due to: dbcsr_dist_util.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_util.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_dist_util.mod' due to: dbcsr_dist_util.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_util.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_block_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_data_methods_low.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_operations.F dbcsr_block_operations.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_block_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_block_operations.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_operations.F:939:61: + + 939 | dst_sizes(1), dst_sizes(2)) + | ^ +Warning: 'src_ub[1]' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_block_operations.mod' due to: dbcsr_block_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_data_methods_low.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_data_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_util.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_data_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_block_operations.mod dbcsr_base_hooks.mod dbcsr_dist_util.mod dbcsr_data_methods.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_operations.F dbcsr_data_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_data_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_data_operations.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_data_operations.mod' due to: dbcsr_data_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_util.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_dist_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_kinds.mod dbcsr_min_heap.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_operations.F dbcsr_dist_operations.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_dist_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_dist_operations.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_dist_operations.mod' due to: dbcsr_dist_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dist/dbcsr_dist_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_kinds.mod dbcsr_min_heap.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_data_operations.mod' due to: dbcsr_data_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr_data_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_block_operations.mod dbcsr_base_hooks.mod dbcsr_dist_util.mod dbcsr_data_methods.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_index_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_index_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_dist_operations.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod dbcsr_methods.mod dbcsr_ptr_util.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_index_operations.F dbcsr_index_operations.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_index_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_index_operations.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_index_operations.mod' due to: dbcsr_index_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_index_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_dist_operations.mod dbcsr_kinds.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod dbcsr_methods.mod dbcsr_ptr_util.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_iterator_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_iterator_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_ptr_util.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_data_methods.mod dbcsr_kinds.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_iterator_operations.F dbcsr_iterator_operations.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_iterator_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_iterator_operations.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_iterator_operations.mod' due to: dbcsr_iterator_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_iterator_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_ptr_util.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_data_methods.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_work_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/work/dbcsr_work_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_btree.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_mem_methods.mod dbcsr_methods.mod dbcsr_string_utilities.mod dbcsr_base_hooks.mod dbcsr_iterator_operations.mod dbcsr_data_operations.mod dbcsr_dist_util.mod dbcsr_ptr_util.mod dbcsr_index_operations.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_work_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/work/dbcsr_work_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_config.mod dbcsr_ptr_util.mod dbcsr_index_operations.mod dbcsr_methods.mod dbcsr_string_utilities.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_mem_methods.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_btree.mod dbcsr_data_operations.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_iterator_operations.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/work/dbcsr_work_operations.F dbcsr_work_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_work_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/work/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_work_operations.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mp_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_config.mod dbcsr_mp_methods.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_ptr_util.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mp_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_config.mod dbcsr_ptr_util.mod dbcsr_base_hooks.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/dbcsr_mp_operations.F dbcsr_mp_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mp_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mpi/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mp_operations.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_timings.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_timings.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod @@ -1541,7 +1576,7 @@ /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_init.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_init.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/dbcsr_acc_init.F dbcsr_acc_init.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_init.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_init.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_cuda_profiling.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/cuda/dbcsr_cuda_profiling.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_cuda_profiling.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/cuda/dbcsr_cuda_profiling.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/cuda/dbcsr_cuda_profiling.F dbcsr_cuda_profiling.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_cuda_profiling.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/cuda/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_cuda_profiling.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_hipblas.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/acc/hip/dbcsr_hipblas.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod @@ -1552,160 +1587,149 @@ mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_timings_base_type.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_timings_base_type.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_timings_base_type.mod' due to: dbcsr_timings_base_type.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_base_type.F dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list_callstackentry.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_callstackentry.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_base_hooks.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_callstackentry.F dbcsr_list_callstackentry.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_list_callstackentry.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_list_callstackentry.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list_callstackentry.mod' due to: dbcsr_list_callstackentry.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_callstackentry.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_dict.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_kinds.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_dict.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.F dbcsr_dict.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_dict.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_dict.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_dict.mod' due to: dbcsr_dict.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_kinds.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_dict.mod' due to: dbcsr_dict.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_dict.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list_routinestat.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinestat.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list_routinestat.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinestat.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinestat.F dbcsr_list_routinestat.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_list_routinestat.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_list_routinestat.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list_routinestat.mod' due to: dbcsr_list_routinestat.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinestat.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list_routinestat.mod' due to: dbcsr_list_routinestat.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinestat.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list_callstackentry.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_callstackentry.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_callstackentry.F dbcsr_list_callstackentry.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_list_callstackentry.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_list_callstackentry.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list_callstackentry.mod' due to: dbcsr_list_callstackentry.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_callstackentry.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_timings_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_types.F dbcsr_list_callstackentry.mod dbcsr_dict.mod dbcsr_list_routinestat.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_timings_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_types.F dbcsr_dict.mod dbcsr_list_routinestat.mod dbcsr_list_callstackentry.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_types.F dbcsr_timings_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_timings_types.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_timings_types.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_timings_types.mod' due to: dbcsr_timings_types.o true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_cuda_profiling.mod' due to: dbcsr_cuda_profiling.o -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list_routinereport.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinereport.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list_routinereport.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinereport.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinereport.F dbcsr_list_routinereport.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_list_routinereport.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_list_routinereport.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list_routinereport.mod' due to: dbcsr_list_routinereport.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinereport.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list_routinereport.mod' due to: dbcsr_list_routinereport.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_routinereport.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_base_hooks.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list_timerenv.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_timerenv.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_types.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_files.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_files.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_machine.mod dbcsr_base_hooks.mod dbcsr_kinds.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_files.F dbcsr_files.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_files.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_files.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_files.mod' due to: dbcsr_files.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_files.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_machine.mod dbcsr_base_hooks.mod dbcsr_kinds.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list_timerenv.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_timerenv.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_types.mod dbcsr_base_hooks.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_timerenv.F dbcsr_list_timerenv.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_list_timerenv.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_list_timerenv.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list_timerenv.mod' due to: dbcsr_list_timerenv.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_timerenv.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_types.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list_timerenv.mod' due to: dbcsr_list_timerenv.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list_timerenv.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_types.mod dbcsr_base_hooks.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_list_routinereport.mod dbcsr_list_timerenv.mod dbcsr_list_routinestat.mod dbcsr_base_hooks.mod dbcsr_list_callstackentry.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_list.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_list_routinereport.mod dbcsr_list_routinestat.mod dbcsr_list_timerenv.mod dbcsr_base_hooks.mod dbcsr_list_callstackentry.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.F dbcsr_list.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_list.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_list.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list.mod' due to: dbcsr_list.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_list_routinereport.mod dbcsr_list_timerenv.mod dbcsr_list_routinestat.mod dbcsr_base_hooks.mod dbcsr_list_callstackentry.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_list.mod' due to: dbcsr_list.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_list.fypp dbcsr_timings_base_type.mod dbcsr_list_routinereport.mod dbcsr_list_routinestat.mod dbcsr_list_timerenv.mod dbcsr_base_hooks.mod dbcsr_list_callstackentry.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_cuda_profiling.mod' due to: dbcsr_cuda_profiling.o true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_timings.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_timings_types.mod dbcsr_acc_devmem.mod dbcsr_machine.mod dbcsr_kinds.mod dbcsr_cuda_profiling.mod dbcsr_dict.mod dbcsr_list.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_timings.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_timings_types.mod dbcsr_cuda_profiling.mod dbcsr_base_hooks.mod dbcsr_machine.mod dbcsr_list.mod dbcsr_dict.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings.F dbcsr_timings.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_timings.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_timings.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_timings.mod' due to: dbcsr_timings.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_timings_types.mod dbcsr_acc_devmem.mod dbcsr_machine.mod dbcsr_kinds.mod dbcsr_cuda_profiling.mod dbcsr_dict.mod dbcsr_list.mod dbcsr_base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_files.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_files.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_machine.mod dbcsr_kinds.mod dbcsr_base_hooks.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_files.F dbcsr_files.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_files.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_files.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_files.mod' due to: dbcsr_files.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_files.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_machine.mod dbcsr_kinds.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_timings.mod' due to: dbcsr_timings.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_timings_types.mod dbcsr_cuda_profiling.mod dbcsr_base_hooks.mod dbcsr_machine.mod dbcsr_list.mod dbcsr_dict.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_timings_report.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_report.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_timings_base_type.mod dbcsr_timings_types.mod dbcsr_types.mod dbcsr_timings.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_list_routinereport.mod dbcsr_toollib.mod dbcsr_list.mod dbcsr_dict.mod dbcsr_base_hooks.mod dbcsr_files.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_timings_report.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_report.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_timings_base_type.mod dbcsr_timings_types.mod dbcsr_list_routinereport.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_files.mod dbcsr_list.mod dbcsr_timings.mod dbcsr_dict.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_timings_report.F dbcsr_timings_report.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_timings_report.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_timings_report.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_print_messages.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_print_messages.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_print_messages.F dbcsr_print_messages.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_print_messages.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_print_messages.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_iter_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_iter_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_iter_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_iter_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_iter_types.F dbcsr_iter_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_iter_types.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_iter_types.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_iter_types.mod' due to: dbcsr_iter_types.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_iter_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_iter_types.mod' due to: dbcsr_iter_types.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_iter_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_log_handling.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_log_handling.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_iter_types.mod dbcsr_types.mod dbcsr_machine.mod dbcsr_timings.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_methods.mod dbcsr_files.mod dbcsr_string_utilities.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_log_handling.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_log_handling.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_iter_types.mod dbcsr_methods.mod dbcsr_string_utilities.mod dbcsr_base_hooks.mod dbcsr_files.mod dbcsr_timings.mod dbcsr_machine.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_log_handling.F dbcsr_log_handling.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_log_handling.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_log_handling.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_timings_report.mod' due to: dbcsr_timings_report.o true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_log_handling.mod' due to: dbcsr_log_handling.o +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_types.F +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_types.F dbcsr_mm_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_types.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_types.mod' due to: dbcsr_mm_types.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_types.F true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_print_messages.mod' due to: dbcsr_print_messages.o +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_hostdrv.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_hostdrv.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_mm_types.mod dbcsr_config.mod dbcsr_base_hooks.mod dbcsr_data_methods.mod dbcsr_kinds.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_hostdrv.F dbcsr_mm_hostdrv.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_hostdrv.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_hostdrv.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_hostdrv.mod' due to: dbcsr_mm_hostdrv.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_hostdrv.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_mm_types.mod dbcsr_config.mod dbcsr_base_hooks.mod dbcsr_data_methods.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_error_handling.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_error_handling.F dbcsr_machine.mod dbcsr_timings.mod dbcsr_mpiwrap.mod dbcsr_kinds.mod dbcsr_print_messages.mod dbcsr_log_handling.mod dbcsr_base_hooks.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_error_handling.F dbcsr_error_handling.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_error_handling.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_error_handling.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_error_handling.mod' due to: dbcsr_error_handling.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_error_handling.F dbcsr_machine.mod dbcsr_timings.mod dbcsr_mpiwrap.mod dbcsr_kinds.mod dbcsr_print_messages.mod dbcsr_log_handling.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_acc_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mm_types.mod dbcsr_config.mod dbcsr_base_hooks.mod dbcsr_acc_stream.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_acc_operations.F dbcsr_acc_operations.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_operations.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_operations.mod' due to: dbcsr_acc_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_acc_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mm_types.mod dbcsr_config.mod dbcsr_base_hooks.mod dbcsr_acc_stream.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_accdrv.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_accdrv.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mm_types.mod dbcsr_acc_event.mod dbcsr_config.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_mem_methods.mod dbcsr_acc_hostmem.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_acc_devmem.mod dbcsr_block_operations.mod dbcsr_acc_stream.mod dbcsr_acc_operations.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_accdrv.F dbcsr_mm_accdrv.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_accdrv.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_accdrv.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_accdrv.mod' due to: dbcsr_mm_accdrv.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_accdrv.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mm_types.mod dbcsr_acc_event.mod dbcsr_config.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_mem_methods.mod dbcsr_acc_hostmem.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_acc_devmem.mod dbcsr_block_operations.mod dbcsr_acc_stream.mod dbcsr_acc_operations.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_sched.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_sched.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mm_types.mod dbcsr_config.mod dbcsr_block_operations.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_mm_hostdrv.mod dbcsr_mm_accdrv.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_sched.F dbcsr_mm_sched.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_sched.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_sched.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_sched.mod' due to: dbcsr_mm_sched.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_sched.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mm_types.mod dbcsr_config.mod dbcsr_block_operations.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_mm_hostdrv.mod dbcsr_mm_accdrv.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod true /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_work_operations.mod' due to: dbcsr_work_operations.o true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mp_operations.mod' due to: dbcsr_mp_operations.o +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_dist_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_dist_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_dist_operations.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_mp_methods.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_dist_operations.F dbcsr_mm_dist_operations.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_dist_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_dist_operations.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_dist_operations.mod' due to: dbcsr_mm_dist_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_dist_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_dist_operations.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_mp_methods.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_blas_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_blas_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_kinds.mod dbcsr_base_hooks.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_blas_operations.F dbcsr_blas_operations.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_blas_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_blas_operations.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_blas_operations.mod' due to: dbcsr_blas_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_blas_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_kinds.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mp_operations.mod' due to: dbcsr_mp_operations.o true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_block_access.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_access.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_mp_methods.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_btree.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod dbcsr_methods.mod dbcsr_ptr_util.mod dbcsr_index_operations.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_block_access.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_access.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_dist_operations.mod dbcsr_ptr_util.mod dbcsr_index_operations.mod dbcsr_work_operations.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_btree.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_mp_methods.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_access.F dbcsr_block_access.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_block_access.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_block_access.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_block_access.mod' due to: dbcsr_block_access.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_access.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_mp_methods.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_btree.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod dbcsr_methods.mod dbcsr_ptr_util.mod dbcsr_index_operations.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_block_access.mod' due to: dbcsr_block_access.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/block/dbcsr_block_access.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_dist_operations.mod dbcsr_ptr_util.mod dbcsr_index_operations.mod dbcsr_work_operations.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_btree.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_mp_methods.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_config.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_data_methods.mod dbcsr_data_operations.mod dbcsr_dist_util.mod dbcsr_index_operations.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_iterator_operations.mod dbcsr_ptr_util.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_mpiwrap.mod dbcsr_blas_operations.mod dbcsr_block_access.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_blas_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_blas_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_base_hooks.mod dbcsr_kinds.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_blas_operations.F dbcsr_blas_operations.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_blas_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_blas_operations.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_blas_operations.mod' due to: dbcsr_blas_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_blas_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_base_hooks.mod dbcsr_kinds.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_iterator_operations.mod dbcsr_dist_operations.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_ptr_util.mod dbcsr_blas_operations.mod dbcsr_block_access.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod dbcsr_config.mod dbcsr_index_operations.mod dbcsr_methods.mod dbcsr_data_operations.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_operations.F dbcsr_operations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_operations.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_operations.mod' due to: dbcsr_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_config.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_data_methods.mod dbcsr_data_operations.mod dbcsr_dist_util.mod dbcsr_index_operations.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_iterator_operations.mod dbcsr_ptr_util.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_mpiwrap.mod dbcsr_blas_operations.mod dbcsr_block_access.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_operations.mod' due to: dbcsr_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_iterator_operations.mod dbcsr_dist_operations.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_ptr_util.mod dbcsr_blas_operations.mod dbcsr_block_access.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod dbcsr_config.mod dbcsr_index_operations.mod dbcsr_methods.mod dbcsr_data_operations.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_transformations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_transformations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_data_methods.mod dbcsr_mp_operations.mod dbcsr_data_operations.mod dbcsr_dist_util.mod dbcsr_index_operations.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_iterator_operations.mod dbcsr_ptr_util.mod dbcsr_dist_methods.mod dbcsr_operations.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_mpiwrap.mod dbcsr_block_access.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_transformations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_transformations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_mp_operations.mod dbcsr_iterator_operations.mod dbcsr_dist_operations.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_ptr_util.mod dbcsr_block_access.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod dbcsr_operations.mod dbcsr_index_operations.mod dbcsr_methods.mod dbcsr_data_operations.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_transformations.F dbcsr_transformations.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_transformations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_transformations.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_transformations.mod' due to: dbcsr_transformations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_transformations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_data_methods.mod dbcsr_mp_operations.mod dbcsr_data_operations.mod dbcsr_dist_util.mod dbcsr_index_operations.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_iterator_operations.mod dbcsr_ptr_util.mod dbcsr_dist_methods.mod dbcsr_operations.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_mpiwrap.mod dbcsr_block_access.mod dbcsr_methods.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_types.F -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_types.F dbcsr_mm_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_types.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_types.mod' due to: dbcsr_mm_types.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_types.F -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_acc_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_acc_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_stream.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_acc_operations.F dbcsr_acc_operations.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_acc_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_acc_operations.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_operations.mod' due to: dbcsr_acc_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_acc_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_acc_stream.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_accdrv.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_accdrv.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_mem_methods.mod dbcsr_acc_hostmem.mod dbcsr_base_hooks.mod dbcsr_acc_event.mod dbcsr_acc_operations.mod dbcsr_acc_stream.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_accdrv.F dbcsr_mm_accdrv.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_accdrv.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_accdrv.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_accdrv.mod' due to: dbcsr_mm_accdrv.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_accdrv.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_acc_devmem.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_mem_methods.mod dbcsr_acc_hostmem.mod dbcsr_base_hooks.mod dbcsr_acc_event.mod dbcsr_acc_operations.mod dbcsr_acc_stream.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_hostdrv.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_hostdrv.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_mm_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_hostdrv.F dbcsr_mm_hostdrv.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_hostdrv.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_hostdrv.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_hostdrv.mod' due to: dbcsr_mm_hostdrv.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_hostdrv.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_mm_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_transformations.mod' due to: dbcsr_transformations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_transformations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_mp_operations.mod dbcsr_iterator_operations.mod dbcsr_dist_operations.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_ptr_util.mod dbcsr_block_access.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod dbcsr_operations.mod dbcsr_index_operations.mod dbcsr_methods.mod dbcsr_data_operations.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_sched.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_sched.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_mm_accdrv.mod dbcsr_mm_hostdrv.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_sched.F dbcsr_mm_sched.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_sched.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_sched.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_sched.mod' due to: dbcsr_mm_sched.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_sched.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_mm_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_mm_accdrv.mod dbcsr_mm_hostdrv.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_io.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_io.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_work_operations.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_dist_methods.mod dbcsr_mp_operations.mod dbcsr_machine.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_io.F dbcsr_io.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_io.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_io.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_io.mod' due to: dbcsr_io.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_io.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_work_operations.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_dist_methods.mod dbcsr_mp_operations.mod dbcsr_machine.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_csr.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_csr.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table_types.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table.f90 dbcsr_array_types.mod dbcsr_mm_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_util.mod dbcsr_ptr_util.mod dbcsr_mm_sched.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_csr.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_csr.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table_types.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_mm_types.mod dbcsr_config.mod dbcsr_ptr_util.mod dbcsr_mm_sched.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_block_operations.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_csr.F dbcsr_mm_csr.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_csr.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_csr.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_csr.mod' due to: dbcsr_mm_csr.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_csr.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table_types.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table.f90 dbcsr_array_types.mod dbcsr_mm_types.mod dbcsr_types.mod dbcsr_config.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_toollib.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_dist_util.mod dbcsr_ptr_util.mod dbcsr_mm_sched.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_csr.mod' due to: dbcsr_mm_csr.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_csr.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table_types.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/utils/dbcsr_hash_table.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_mm_types.mod dbcsr_config.mod dbcsr_ptr_util.mod dbcsr_mm_sched.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_block_operations.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_multrec.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_multrec.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_types.mod dbcsr_mm_csr.mod dbcsr_config.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_multrec.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_multrec.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_mm_csr.mod dbcsr_config.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_kinds.mod dbcsr_block_operations.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_multrec.F dbcsr_mm_multrec.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_multrec.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_multrec.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_multrec.mod' due to: dbcsr_mm_multrec.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_multrec.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_types.mod dbcsr_mm_csr.mod dbcsr_config.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_multrec.mod' due to: dbcsr_mm_multrec.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_multrec.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_mm_csr.mod dbcsr_config.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_kinds.mod dbcsr_block_operations.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_common.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_common.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_types.mod dbcsr_work_operations.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_methods.mod dbcsr_mm_multrec.mod dbcsr_base_hooks.mod dbcsr_acc_event.mod dbcsr_acc_operations.mod dbcsr_ptr_util.mod dbcsr_acc_stream.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_common.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_common.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_acc_event.mod dbcsr_mm_multrec.mod dbcsr_ptr_util.mod dbcsr_work_operations.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_acc_stream.mod dbcsr_acc_operations.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_common.F dbcsr_mm_common.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_common.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_common.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_common.mod' due to: dbcsr_mm_common.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_common.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_array_types.mod dbcsr_types.mod dbcsr_work_operations.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_methods.mod dbcsr_mm_multrec.mod dbcsr_base_hooks.mod dbcsr_acc_event.mod dbcsr_acc_operations.mod dbcsr_ptr_util.mod dbcsr_acc_stream.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_init.mod' due to: dbcsr_acc_init.o -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_io.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_io.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_machine.mod dbcsr_work_operations.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_mp_operations.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_methods.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_io.F dbcsr_io.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_io.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_io.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_io.mod' due to: dbcsr_io.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_io.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_machine.mod dbcsr_work_operations.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_mp_operations.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_methods.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_dist_operations.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_dist_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_dist_operations.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod dbcsr_methods.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_dist_operations.F dbcsr_mm_dist_operations.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_dist_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_dist_operations.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_dist_operations.mod' due to: dbcsr_mm_dist_operations.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_dist_operations.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_array_types.mod dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_dist_operations.mod dbcsr_toollib.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_common.mod' due to: dbcsr_mm_common.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_common.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_acc_event.mod dbcsr_mm_multrec.mod dbcsr_ptr_util.mod dbcsr_work_operations.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_acc_stream.mod dbcsr_acc_operations.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_cannon.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_cannon.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_data_types.mod dbcsr_array_types.mod dbcsr_config.mod dbcsr_work_operations.mod dbcsr_data_methods.mod dbcsr_mp_operations.mod dbcsr_dist_util.mod dbcsr_index_operations.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_acc_event.mod dbcsr_iterator_operations.mod dbcsr_ptr_util.mod dbcsr_machine.mod dbcsr_mm_common.mod dbcsr_dist_methods.mod dbcsr_mm_multrec.mod dbcsr_operations.mod dbcsr_io.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_mpiwrap.mod dbcsr_mem_methods.mod dbcsr_mm_dist_operations.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_cannon.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_cannon.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_types.mod dbcsr_array_types.mod dbcsr_acc_event.mod dbcsr_mem_methods.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_mp_operations.mod dbcsr_kinds.mod dbcsr_iterator_operations.mod dbcsr_work_operations.mod dbcsr_mm_dist_operations.mod dbcsr_base_hooks.mod dbcsr_io.mod dbcsr_machine.mod dbcsr_data_methods.mod dbcsr_ptr_util.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod dbcsr_config.mod dbcsr_operations.mod dbcsr_mm_multrec.mod dbcsr_mm_common.mod dbcsr_index_operations.mod dbcsr_methods.mod dbcsr_transformations.mod dbcsr_block_operations.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_cannon.F dbcsr_mm_cannon.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_cannon.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_cannon.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_cannon.mod' due to: dbcsr_mm_cannon.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_cannon.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_data_types.mod dbcsr_array_types.mod dbcsr_config.mod dbcsr_work_operations.mod dbcsr_data_methods.mod dbcsr_mp_operations.mod dbcsr_dist_util.mod dbcsr_index_operations.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_acc_event.mod dbcsr_iterator_operations.mod dbcsr_ptr_util.mod dbcsr_machine.mod dbcsr_mm_common.mod dbcsr_dist_methods.mod dbcsr_mm_multrec.mod dbcsr_operations.mod dbcsr_io.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_mpiwrap.mod dbcsr_mem_methods.mod dbcsr_mm_dist_operations.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_cannon.mod' due to: dbcsr_mm_cannon.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_cannon.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_data_types.mod dbcsr_types.mod dbcsr_array_types.mod dbcsr_acc_event.mod dbcsr_mem_methods.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_mp_operations.mod dbcsr_kinds.mod dbcsr_iterator_operations.mod dbcsr_work_operations.mod dbcsr_mm_dist_operations.mod dbcsr_base_hooks.mod dbcsr_io.mod dbcsr_machine.mod dbcsr_data_methods.mod dbcsr_ptr_util.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod dbcsr_config.mod dbcsr_operations.mod dbcsr_mm_multrec.mod dbcsr_mm_common.mod dbcsr_index_operations.mod dbcsr_methods.mod dbcsr_transformations.mod dbcsr_block_operations.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_3d.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_3d.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_data_types.mod dbcsr_array_types.mod dbcsr_config.mod dbcsr_work_operations.mod dbcsr_data_methods.mod dbcsr_mp_operations.mod dbcsr_dist_util.mod dbcsr_index_operations.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_acc_event.mod dbcsr_iterator_operations.mod dbcsr_ptr_util.mod dbcsr_machine.mod dbcsr_mm_common.mod dbcsr_dist_methods.mod dbcsr_mm_multrec.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_mpiwrap.mod dbcsr_mem_methods.mod dbcsr_mm_dist_operations.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm_3d.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_3d.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_types.mod dbcsr_array_types.mod dbcsr_acc_event.mod dbcsr_mem_methods.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_mp_operations.mod dbcsr_iterator_operations.mod dbcsr_work_operations.mod dbcsr_mm_dist_operations.mod dbcsr_base_hooks.mod dbcsr_machine.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_ptr_util.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod dbcsr_config.mod dbcsr_mm_multrec.mod dbcsr_mm_common.mod dbcsr_index_operations.mod dbcsr_methods.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_3d.F dbcsr_mm_3d.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm_3d.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm_3d.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_3d.F:1890:60: @@ -1718,30 +1742,41 @@ 1889 | right_buffer_p => right_buffers(iright_buffer_calc) | ^ Warning: 'iright_buffer_calc' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_3d.mod' due to: dbcsr_mm_3d.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_3d.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_data_types.mod dbcsr_array_types.mod dbcsr_config.mod dbcsr_work_operations.mod dbcsr_data_methods.mod dbcsr_mp_operations.mod dbcsr_dist_util.mod dbcsr_index_operations.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_acc_event.mod dbcsr_iterator_operations.mod dbcsr_ptr_util.mod dbcsr_machine.mod dbcsr_mm_common.mod dbcsr_dist_methods.mod dbcsr_mm_multrec.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_mpiwrap.mod dbcsr_mem_methods.mod dbcsr_mm_dist_operations.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm_3d.mod' due to: dbcsr_mm_3d.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm_3d.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_types.mod dbcsr_array_types.mod dbcsr_acc_event.mod dbcsr_mem_methods.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_mp_operations.mod dbcsr_iterator_operations.mod dbcsr_work_operations.mod dbcsr_mm_dist_operations.mod dbcsr_base_hooks.mod dbcsr_machine.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_ptr_util.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod dbcsr_config.mod dbcsr_mm_multrec.mod dbcsr_mm_common.mod dbcsr_index_operations.mod dbcsr_methods.mod dbcsr_kinds.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_acc_init.mod' due to: dbcsr_acc_init.o true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_config.mod dbcsr_work_operations.mod dbcsr_data_methods.mod dbcsr_dist_util.mod dbcsr_acc_device.mod dbcsr_index_operations.mod dbcsr_acc_stream.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_mm_sched.mod dbcsr_machine.mod dbcsr_mm_common.mod dbcsr_dist_methods.mod dbcsr_mm_multrec.mod dbcsr_acc_init.mod dbcsr_operations.mod dbcsr_io.mod dbcsr_string_utilities.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_mem_methods.mod dbcsr_mm_dist_operations.mod dbcsr_methods.mod dbcsr_mm_cannon.mod dbcsr_mm_3d.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_mm.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_acc_device.mod dbcsr_mm_sched.mod dbcsr_mem_methods.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_work_operations.mod dbcsr_mm_dist_operations.mod dbcsr_base_hooks.mod dbcsr_io.mod dbcsr_machine.mod dbcsr_data_methods.mod dbcsr_acc_stream.mod dbcsr_mm_cannon.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod dbcsr_config.mod dbcsr_operations.mod dbcsr_mm_3d.mod dbcsr_mm_common.mod dbcsr_mm_multrec.mod dbcsr_index_operations.mod dbcsr_methods.mod dbcsr_string_utilities.mod dbcsr_transformations.mod dbcsr_acc_init.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm.F dbcsr_mm.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_mm.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_mm.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm.mod' due to: dbcsr_mm.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_config.mod dbcsr_work_operations.mod dbcsr_data_methods.mod dbcsr_dist_util.mod dbcsr_acc_device.mod dbcsr_index_operations.mod dbcsr_acc_stream.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_mm_sched.mod dbcsr_machine.mod dbcsr_mm_common.mod dbcsr_dist_methods.mod dbcsr_mm_multrec.mod dbcsr_acc_init.mod dbcsr_operations.mod dbcsr_io.mod dbcsr_string_utilities.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_mem_methods.mod dbcsr_mm_dist_operations.mod dbcsr_methods.mod dbcsr_mm_cannon.mod dbcsr_mm_3d.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_mm.mod' due to: dbcsr_mm.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_mm.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_array_types.mod dbcsr_acc_device.mod dbcsr_mm_sched.mod dbcsr_mem_methods.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_work_operations.mod dbcsr_mm_dist_operations.mod dbcsr_base_hooks.mod dbcsr_io.mod dbcsr_machine.mod dbcsr_data_methods.mod dbcsr_acc_stream.mod dbcsr_mm_cannon.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod dbcsr_config.mod dbcsr_operations.mod dbcsr_mm_3d.mod dbcsr_mm_common.mod dbcsr_mm_multrec.mod dbcsr_index_operations.mod dbcsr_methods.mod dbcsr_string_utilities.mod dbcsr_transformations.mod dbcsr_acc_init.mod dbcsr_kinds.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_log_handling.mod' due to: dbcsr_log_handling.o +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_print_messages.mod' due to: dbcsr_print_messages.o +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_error_handling.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_error_handling.F dbcsr_print_messages.mod dbcsr_base_hooks.mod dbcsr_log_handling.mod dbcsr_timings.mod dbcsr_machine.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_error_handling.F dbcsr_error_handling.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_error_handling.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_error_handling.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_error_handling.mod' due to: dbcsr_error_handling.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_error_handling.F dbcsr_print_messages.mod dbcsr_base_hooks.mod dbcsr_log_handling.mod dbcsr_timings.mod dbcsr_machine.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_lib.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_lib.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_timings_report.mod dbcsr_config.mod dbcsr_machine.mod dbcsr_timings.mod dbcsr_mp_methods.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_log_handling.mod dbcsr_error_handling.mod dbcsr_base_hooks.mod dbcsr_mm.mod dbcsr_acc_device.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_lib.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_lib.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_config.mod dbcsr_acc_device.mod dbcsr_timings_report.mod dbcsr_mm.mod dbcsr_base_hooks.mod dbcsr_log_handling.mod dbcsr_error_handling.mod dbcsr_timings.mod dbcsr_machine.mod dbcsr_kinds.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/dbcsr_lib.F dbcsr_lib.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_lib.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/core/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_lib.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_multiply_api.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_multiply_api.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_mm.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_multiply_api.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_multiply_api.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_methods.mod dbcsr_mm.mod dbcsr_base_hooks.mod dbcsr_data_methods.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/dbcsr_multiply_api.F dbcsr_multiply_api.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_multiply_api.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/mm/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_multiply_api.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_test_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_test_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_blas_operations.mod dbcsr_base_hooks.mod dbcsr_block_access.mod dbcsr_iterator_operations.mod dbcsr_methods.mod dbcsr_dist_util.mod dbcsr_ptr_util.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_test_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_test_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_dist_operations.mod dbcsr_ptr_util.mod dbcsr_work_operations.mod dbcsr_methods.mod dbcsr_blas_operations.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_mpiwrap.mod dbcsr_block_access.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_mp_methods.mod dbcsr_iterator_operations.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_test_methods.F dbcsr_test_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_test_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_test_methods.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_test_methods.mod' due to: dbcsr_test_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_test_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_kinds.mod dbcsr_block_operations.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_blas_operations.mod dbcsr_base_hooks.mod dbcsr_block_access.mod dbcsr_iterator_operations.mod dbcsr_methods.mod dbcsr_dist_util.mod dbcsr_ptr_util.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_test_methods.mod' due to: dbcsr_test_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_test_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_dist_operations.mod dbcsr_ptr_util.mod dbcsr_work_operations.mod dbcsr_methods.mod dbcsr_blas_operations.mod dbcsr_base_hooks.mod dbcsr_dist_methods.mod dbcsr_mpiwrap.mod dbcsr_block_access.mod dbcsr_dist_util.mod dbcsr_kinds.mod dbcsr_data_methods.mod dbcsr_block_operations.mod dbcsr_mp_methods.mod dbcsr_iterator_operations.mod true /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_multiply_api.mod' due to: dbcsr_multiply_api.o true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tests.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_tests.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_machine.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_operations.mod dbcsr_test_methods.mod dbcsr_io.mod dbcsr_dist_util.mod dbcsr_multiply_api.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tests.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_tests.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_dist_operations.mod dbcsr_operations.mod dbcsr_work_operations.mod dbcsr_test_methods.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_dist_methods.mod dbcsr_io.mod dbcsr_dist_util.mod dbcsr_multiply_api.mod dbcsr_machine.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_tests.F dbcsr_tests.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tests.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tests.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_csr_conversions.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_csr_conversions.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_work_operations.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_base_hooks.mod dbcsr_block_access.mod dbcsr_transformations.mod dbcsr_operations.mod dbcsr_iterator_operations.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_csr_conversions.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_csr_conversions.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_types.mod dbcsr_operations.mod dbcsr_work_operations.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_dist_methods.mod dbcsr_mpiwrap.mod dbcsr_block_access.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_mp_methods.mod dbcsr_iterator_operations.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_csr_conversions.F dbcsr_csr_conversions.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_csr_conversions.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_csr_conversions.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/ops/dbcsr_csr_conversions.F:862:49: @@ -1754,22 +1789,22 @@ 863 | csr_mat%dbcsr_mapping%dbcsr_col_blk_size = dbcsr_col_block_sizes(dbcsr_mat_nosym) | 1 Warning: POINTER-valued function appears on right-hand side of assignment at (1) [-Wsurprising] -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_global.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_global.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_toollib.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_global.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_global.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_toollib.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_global.F dbcsr_tas_global.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_global.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_global.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_global.mod' due to: dbcsr_tas_global.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_global.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_toollib.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_global.mod' due to: dbcsr_tas_global.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_global.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_toollib.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_tas_global.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_types.mod dbcsr_base_hooks.mod dbcsr_tas_global.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_types.F dbcsr_tas_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_types.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_types.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_types.mod' due to: dbcsr_tas_types.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_types.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_tas_global.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_types.mod' due to: dbcsr_tas_types.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_types.mod dbcsr_base_hooks.mod dbcsr_tas_global.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_util.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_util.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_base_hooks.mod dbcsr_index_operations.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_util.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_util.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_index_operations.mod dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_util.F dbcsr_tas_util.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_util.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_util.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_util.mod' due to: dbcsr_tas_util.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_util.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_mp_methods.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_base_hooks.mod dbcsr_index_operations.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_util.mod' due to: dbcsr_tas_util.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_util.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_index_operations.mod dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_split.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tas_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_tas_util.mod dbcsr_tas_global.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_split.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tas_types.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_tas_global.mod dbcsr_tas_util.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F dbcsr_tas_split.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_split.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_split.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F:531:44: @@ -1784,24 +1819,24 @@ | ^ Warning: 'pcoord_group[1]' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F:496:94: Warning: 'pcoord_group[0]' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_split.mod' due to: dbcsr_tas_split.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tas_types.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_tas_util.mod dbcsr_tas_global.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_split.mod' due to: dbcsr_tas_split.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_split.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tas_types.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_tas_global.mod dbcsr_tas_util.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_base.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_base.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_types.mod dbcsr_tas_types.mod dbcsr_work_operations.mod dbcsr_kinds.mod dbcsr_tas_split.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_data_methods_low.mod dbcsr_base_hooks.mod dbcsr_block_access.mod dbcsr_tas_util.mod dbcsr_operations.mod dbcsr_iterator_operations.mod dbcsr_methods.mod dbcsr_tas_global.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_base.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_base.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp dbcsr_data_types.mod dbcsr_types.mod dbcsr_tas_types.mod dbcsr_operations.mod dbcsr_work_operations.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_iterator_operations.mod dbcsr_dist_methods.mod dbcsr_mpiwrap.mod dbcsr_block_access.mod dbcsr_tas_global.mod dbcsr_tas_util.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_tas_split.mod dbcsr_data_methods_low.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_base.F dbcsr_tas_base.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_base.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_base.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_base.mod' due to: dbcsr_tas_base.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_base.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_types.mod dbcsr_tas_types.mod dbcsr_work_operations.mod dbcsr_kinds.mod dbcsr_tas_split.mod dbcsr_mpiwrap.mod dbcsr_data_methods.mod dbcsr_dist_methods.mod dbcsr_data_methods_low.mod dbcsr_base_hooks.mod dbcsr_block_access.mod dbcsr_tas_util.mod dbcsr_operations.mod dbcsr_iterator_operations.mod dbcsr_methods.mod dbcsr_tas_global.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_reshape_ops.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_reshape_ops.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_tas_split.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_iterator_operations.mod dbcsr_tas_base.mod dbcsr_data_methods_low.mod dbcsr_dist_methods.mod dbcsr_operations.mod dbcsr_tas_global.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_block_access.mod dbcsr_tas_util.mod dbcsr_methods.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_reshape_ops.F dbcsr_tas_reshape_ops.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_reshape_ops.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_reshape_ops.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_reshape_ops.mod' due to: dbcsr_tas_reshape_ops.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_reshape_ops.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_tas_split.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_iterator_operations.mod dbcsr_tas_base.mod dbcsr_data_methods_low.mod dbcsr_dist_methods.mod dbcsr_operations.mod dbcsr_tas_global.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_block_access.mod dbcsr_tas_util.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_base.mod' due to: dbcsr_tas_base.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_base.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp dbcsr_data_types.mod dbcsr_types.mod dbcsr_tas_types.mod dbcsr_operations.mod dbcsr_work_operations.mod dbcsr_methods.mod dbcsr_base_hooks.mod dbcsr_iterator_operations.mod dbcsr_dist_methods.mod dbcsr_mpiwrap.mod dbcsr_block_access.mod dbcsr_tas_global.mod dbcsr_tas_util.mod dbcsr_data_methods.mod dbcsr_kinds.mod dbcsr_tas_split.mod dbcsr_data_methods_low.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_io.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_io.F dbcsr_tas_types.mod dbcsr_kinds.mod dbcsr_tas_base.mod dbcsr_tas_split.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_tas_global.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_io.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_io.F dbcsr_tas_types.mod dbcsr_dist_methods.mod dbcsr_tas_global.mod dbcsr_tas_base.mod dbcsr_kinds.mod dbcsr_tas_split.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_io.F dbcsr_tas_io.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_io.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_io.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_io.mod' due to: dbcsr_tas_io.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_io.F dbcsr_tas_types.mod dbcsr_kinds.mod dbcsr_tas_base.mod dbcsr_tas_split.mod dbcsr_mpiwrap.mod dbcsr_dist_methods.mod dbcsr_tas_global.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_io.mod' due to: dbcsr_tas_io.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_io.F dbcsr_tas_types.mod dbcsr_dist_methods.mod dbcsr_tas_global.mod dbcsr_tas_base.mod dbcsr_kinds.mod dbcsr_tas_split.mod dbcsr_mpiwrap.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_reshape_ops.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_reshape_ops.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp dbcsr_data_types.mod dbcsr_types.mod dbcsr_tas_types.mod dbcsr_dist_methods.mod dbcsr_tas_base.mod dbcsr_iterator_operations.mod dbcsr_dist_operations.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_data_methods.mod dbcsr_tas_split.mod dbcsr_block_access.mod dbcsr_mpiwrap.mod dbcsr_operations.mod dbcsr_methods.mod dbcsr_tas_global.mod dbcsr_tas_util.mod dbcsr_kinds.mod dbcsr_data_methods_low.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_reshape_ops.F dbcsr_tas_reshape_ops.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_reshape_ops.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_reshape_ops.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_reshape_ops.mod' due to: dbcsr_tas_reshape_ops.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_reshape_ops.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp dbcsr_data_types.mod dbcsr_types.mod dbcsr_tas_types.mod dbcsr_dist_methods.mod dbcsr_tas_base.mod dbcsr_iterator_operations.mod dbcsr_dist_operations.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_data_methods.mod dbcsr_tas_split.mod dbcsr_block_access.mod dbcsr_mpiwrap.mod dbcsr_operations.mod dbcsr_methods.mod dbcsr_tas_global.mod dbcsr_tas_util.mod dbcsr_kinds.mod dbcsr_data_methods_low.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_mm.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_config.mod dbcsr_work_operations.mod dbcsr_tas_split.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_tas_reshape_ops.mod dbcsr_multiply_api.mod dbcsr_tas_base.mod dbcsr_tas_io.mod dbcsr_dist_methods.mod dbcsr_operations.mod dbcsr_tas_global.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_tas_util.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_mm.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp dbcsr_data_types.mod dbcsr_types.mod dbcsr_tas_types.mod dbcsr_dist_methods.mod dbcsr_tas_base.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_tas_io.mod dbcsr_multiply_api.mod dbcsr_data_methods.mod dbcsr_tas_split.mod dbcsr_mpiwrap.mod dbcsr_operations.mod dbcsr_config.mod dbcsr_methods.mod dbcsr_transformations.mod dbcsr_tas_global.mod dbcsr_tas_util.mod dbcsr_tas_reshape_ops.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F dbcsr_tas_mm.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_mm.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_mm.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F:1457:128: @@ -1831,65 +1866,65 @@ 482 | DEALLOCATE (matrix_b_rep) | ^ Warning: 'matrix_b_rep' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_mm.mod' due to: dbcsr_tas_mm.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_config.mod dbcsr_work_operations.mod dbcsr_tas_split.mod dbcsr_data_methods.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_tas_reshape_ops.mod dbcsr_multiply_api.mod dbcsr_tas_base.mod dbcsr_tas_io.mod dbcsr_dist_methods.mod dbcsr_operations.mod dbcsr_tas_global.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_tas_util.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_mm.mod' due to: dbcsr_tas_mm.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_mm.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas.fypp dbcsr_data_types.mod dbcsr_types.mod dbcsr_tas_types.mod dbcsr_dist_methods.mod dbcsr_tas_base.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_tas_io.mod dbcsr_multiply_api.mod dbcsr_data_methods.mod dbcsr_tas_split.mod dbcsr_mpiwrap.mod dbcsr_operations.mod dbcsr_config.mod dbcsr_methods.mod dbcsr_transformations.mod dbcsr_tas_global.mod dbcsr_tas_util.mod dbcsr_tas_reshape_ops.mod dbcsr_kinds.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_csr_conversions.mod' due to: dbcsr_csr_conversions.o +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_lib.mod' due to: dbcsr_lib.o +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tests.mod' due to: dbcsr_tests.o +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_api.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dbcsr_api.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_iterator_operations.mod dbcsr_dist_operations.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_io.mod dbcsr_multiply_api.mod dbcsr_csr_conversions.mod dbcsr_data_methods.mod dbcsr_test_methods.mod dbcsr_block_access.mod dbcsr_lib.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod dbcsr_config.mod dbcsr_operations.mod dbcsr_methods.mod dbcsr_string_utilities.mod dbcsr_transformations.mod dbcsr_tests.mod dbcsr_kinds.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dbcsr_api.F dbcsr_api.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_api.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_api.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_api.mod' due to: dbcsr_api.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dbcsr_api.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_iterator_operations.mod dbcsr_dist_operations.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_io.mod dbcsr_multiply_api.mod dbcsr_csr_conversions.mod dbcsr_data_methods.mod dbcsr_test_methods.mod dbcsr_block_access.mod dbcsr_lib.mod dbcsr_mp_methods.mod dbcsr_mpiwrap.mod dbcsr_config.mod dbcsr_operations.mod dbcsr_methods.mod dbcsr_string_utilities.mod dbcsr_transformations.mod dbcsr_tests.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_allocate_wrap.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_allocate_wrap.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_allocate_wrap.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_allocate_wrap.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_base_hooks.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_allocate_wrap.F dbcsr_allocate_wrap.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_allocate_wrap.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_allocate_wrap.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_allocate_wrap.mod' due to: dbcsr_allocate_wrap.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_allocate_wrap.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_kinds.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_allocate_wrap.mod' due to: dbcsr_allocate_wrap.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_allocate_wrap.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_base_hooks.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_index.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_index.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_allocate_wrap.mod dbcsr_kinds.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_index.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_index.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_allocate_wrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_index.F dbcsr_tensor_index.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_index.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_index.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_index.mod' due to: dbcsr_tensor_index.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_index.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_base_hooks.mod dbcsr_allocate_wrap.mod dbcsr_kinds.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_index.mod' due to: dbcsr_tensor_index.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_index.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_base_hooks.mod dbcsr_kinds.mod dbcsr_allocate_wrap.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_array_list_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_array_list_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_index.mod dbcsr_allocate_wrap.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_array_list_methods.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_array_list_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_index.mod dbcsr_base_hooks.mod dbcsr_allocate_wrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_array_list_methods.F dbcsr_array_list_methods.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_array_list_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_array_list_methods.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_array_list_methods.mod' due to: dbcsr_array_list_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_array_list_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_index.mod dbcsr_allocate_wrap.mod dbcsr_base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_csr_conversions.mod' due to: dbcsr_csr_conversions.o -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tests.mod' due to: dbcsr_tests.o -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_lib.mod' due to: dbcsr_lib.o -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_api.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dbcsr_api.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_csr_conversions.mod dbcsr_config.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_data_methods.mod dbcsr_tests.mod dbcsr_dist_util.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_test_methods.mod dbcsr_iterator_operations.mod dbcsr_multiply_api.mod dbcsr_dist_methods.mod dbcsr_operations.mod dbcsr_io.mod dbcsr_string_utilities.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_block_access.mod dbcsr_lib.mod dbcsr_methods.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dbcsr_api.F dbcsr_api.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_api.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_api.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_api.mod' due to: dbcsr_api.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/dbcsr_api.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/data/dbcsr.fypp dbcsr_types.mod dbcsr_array_types.mod dbcsr_csr_conversions.mod dbcsr_config.mod dbcsr_work_operations.mod dbcsr_dist_operations.mod dbcsr_data_methods.mod dbcsr_tests.mod dbcsr_dist_util.mod dbcsr_mp_methods.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_test_methods.mod dbcsr_iterator_operations.mod dbcsr_multiply_api.mod dbcsr_dist_methods.mod dbcsr_operations.mod dbcsr_io.mod dbcsr_string_utilities.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_block_access.mod dbcsr_lib.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_array_list_methods.mod' due to: dbcsr_array_list_methods.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_array_list_methods.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_index.mod dbcsr_base_hooks.mod dbcsr_allocate_wrap.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_data_types.mod dbcsr_tas_types.mod dbcsr_tas_mm.mod dbcsr_kinds.mod dbcsr_tas_base.mod dbcsr_tensor_index.mod dbcsr_tas_split.mod dbcsr_mpiwrap.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_operations.mod dbcsr_array_list_methods.mod dbcsr_api.mod dbcsr_tas_global.mod dbcsr_allocate_wrap.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_types.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_types.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_data_types.mod dbcsr_tas_types.mod dbcsr_tas_mm.mod dbcsr_api.mod dbcsr_operations.mod dbcsr_allocate_wrap.mod dbcsr_tensor_index.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_tas_global.mod dbcsr_tas_base.mod dbcsr_array_list_methods.mod dbcsr_kinds.mod dbcsr_tas_split.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_types.F dbcsr_tensor_types.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_types.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_types.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_types.mod' due to: dbcsr_tensor_types.o true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_block.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_block.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_tas_types.mod dbcsr_tensor_index.mod dbcsr_kinds.mod dbcsr_tas_base.mod dbcsr_dist_operations.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_array_list_methods.mod dbcsr_api.mod dbcsr_allocate_wrap.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_block.F dbcsr_tensor_block.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_block.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_block.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_block.mod' due to: dbcsr_tensor_block.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_block.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_tas_types.mod dbcsr_tensor_index.mod dbcsr_kinds.mod dbcsr_tas_base.mod dbcsr_dist_operations.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_array_list_methods.mod dbcsr_api.mod dbcsr_allocate_wrap.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_test.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_test.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_tas_types.mod dbcsr_work_operations.mod dbcsr_tas_split.mod dbcsr_data_methods.mod dbcsr_dist_util.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_multiply_api.mod dbcsr_tas_base.mod dbcsr_dist_methods.mod dbcsr_operations.mod dbcsr_tas_global.mod dbcsr_tas_mm.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_blas_operations.mod dbcsr_tas_util.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tas_test.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_test.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_tas_types.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_tas_base.mod dbcsr_tas_mm.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_multiply_api.mod dbcsr_data_methods.mod dbcsr_tas_split.mod dbcsr_blas_operations.mod dbcsr_mpiwrap.mod dbcsr_operations.mod dbcsr_methods.mod dbcsr_transformations.mod dbcsr_tas_global.mod dbcsr_tas_util.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_test.F dbcsr_tas_test.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tas_test.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tas_test.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_test.mod' due to: dbcsr_tas_test.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_test.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_tas_types.mod dbcsr_work_operations.mod dbcsr_tas_split.mod dbcsr_data_methods.mod dbcsr_dist_util.mod dbcsr_base_hooks.mod dbcsr_transformations.mod dbcsr_multiply_api.mod dbcsr_tas_base.mod dbcsr_dist_methods.mod dbcsr_operations.mod dbcsr_tas_global.mod dbcsr_tas_mm.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_blas_operations.mod dbcsr_tas_util.mod dbcsr_methods.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tas_test.mod' due to: dbcsr_tas_test.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tas/dbcsr_tas_test.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_types.mod dbcsr_tas_types.mod dbcsr_dist_methods.mod dbcsr_dist_util.mod dbcsr_tas_base.mod dbcsr_tas_mm.mod dbcsr_work_operations.mod dbcsr_base_hooks.mod dbcsr_multiply_api.mod dbcsr_data_methods.mod dbcsr_tas_split.mod dbcsr_blas_operations.mod dbcsr_mpiwrap.mod dbcsr_operations.mod dbcsr_methods.mod dbcsr_transformations.mod dbcsr_tas_global.mod dbcsr_tas_util.mod dbcsr_kinds.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_block.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_block.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_tas_types.mod dbcsr_dist_operations.mod dbcsr_api.mod dbcsr_allocate_wrap.mod dbcsr_tensor_index.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_tas_base.mod dbcsr_array_list_methods.mod dbcsr_kinds.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_block.F dbcsr_tensor_block.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_block.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_block.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_block.mod' due to: dbcsr_tensor_block.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_block.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_tas_types.mod dbcsr_dist_operations.mod dbcsr_api.mod dbcsr_allocate_wrap.mod dbcsr_tensor_index.mod dbcsr_toollib.mod dbcsr_base_hooks.mod dbcsr_tas_base.mod dbcsr_array_list_methods.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_io.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_io.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_tensor_block.mod dbcsr_mpiwrap.mod dbcsr_kinds.mod dbcsr_tas_io.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_io.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_io.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_base_hooks.mod dbcsr_tas_io.mod dbcsr_tensor_block.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_io.F dbcsr_tensor_io.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_io.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_io.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_io.mod' due to: dbcsr_tensor_io.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_io.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_tensor_block.mod dbcsr_mpiwrap.mod dbcsr_kinds.mod dbcsr_tas_io.mod dbcsr_base_hooks.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_io.mod' due to: dbcsr_tensor_io.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_io.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_base_hooks.mod dbcsr_tas_io.mod dbcsr_tensor_block.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_split.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_split.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_tensor_block.mod dbcsr_tensor_index.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_array_list_methods.mod dbcsr_api.mod dbcsr_allocate_wrap.mod -python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_split.F dbcsr_tensor_split.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_split.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_split.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_split.mod' due to: dbcsr_tensor_split.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_split.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_tensor_block.mod dbcsr_tensor_index.mod dbcsr_kinds.mod dbcsr_base_hooks.mod dbcsr_array_list_methods.mod dbcsr_api.mod dbcsr_allocate_wrap.mod -true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_reshape.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_reshape.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_tensor_block.mod dbcsr_kinds.mod dbcsr_tas_base.mod dbcsr_mpiwrap.mod dbcsr_base_hooks.mod dbcsr_api.mod dbcsr_allocate_wrap.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_reshape.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_reshape.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_api.mod dbcsr_allocate_wrap.mod dbcsr_base_hooks.mod dbcsr_tensor_block.mod dbcsr_tas_base.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_reshape.F dbcsr_tensor_reshape.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_reshape.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_reshape.F90 -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_reshape.mod' due to: dbcsr_tensor_reshape.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_reshape.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_tensor_block.mod dbcsr_kinds.mod dbcsr_tas_base.mod dbcsr_mpiwrap.mod dbcsr_base_hooks.mod dbcsr_api.mod dbcsr_allocate_wrap.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_reshape.mod' due to: dbcsr_tensor_reshape.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_reshape.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_api.mod dbcsr_allocate_wrap.mod dbcsr_base_hooks.mod dbcsr_tensor_block.mod dbcsr_tas_base.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod +true +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_split.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_split.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_api.mod dbcsr_allocate_wrap.mod dbcsr_tensor_index.mod dbcsr_base_hooks.mod dbcsr_tensor_block.mod dbcsr_array_list_methods.mod dbcsr_kinds.mod +python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_split.F dbcsr_tensor_split.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_split.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_split.F90 +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_split.mod' due to: dbcsr_tensor_split.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_split.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_api.mod dbcsr_allocate_wrap.mod dbcsr_tensor_index.mod dbcsr_base_hooks.mod dbcsr_tensor_block.mod dbcsr_array_list_methods.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_tensor_types.mod dbcsr_dist_operations.mod dbcsr_tas_split.mod dbcsr_tensor_index.mod dbcsr_base_hooks.mod dbcsr_tensor_io.mod dbcsr_api.mod dbcsr_tas_base.mod dbcsr_toollib.mod dbcsr_tensor_split.mod dbcsr_tensor_block.mod dbcsr_tas_mm.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_tensor_reshape.mod dbcsr_array_list_methods.mod dbcsr_allocate_wrap.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_data_types.mod dbcsr_tas_types.mod dbcsr_tensor_index.mod dbcsr_tensor_block.mod dbcsr_tensor_reshape.mod dbcsr_tas_base.mod dbcsr_tas_mm.mod dbcsr_tensor_split.mod dbcsr_dist_operations.mod dbcsr_allocate_wrap.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_tas_split.mod dbcsr_api.mod dbcsr_mpiwrap.mod dbcsr_tensor_io.mod dbcsr_array_list_methods.mod dbcsr_kinds.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.F dbcsr_tensor.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.F:1041:24: @@ -1902,9 +1937,9 @@ 981 | CALL mp_environ(tensor_large%pgrid%mp_comm_2d, 2, pdims_2d, pcoord_2d, periods_2d) | ^ Warning: 'tensor_large' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor.mod' due to: dbcsr_tensor.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tas_types.mod dbcsr_data_types.mod dbcsr_tensor_types.mod dbcsr_dist_operations.mod dbcsr_tas_split.mod dbcsr_tensor_index.mod dbcsr_base_hooks.mod dbcsr_tensor_io.mod dbcsr_api.mod dbcsr_tas_base.mod dbcsr_toollib.mod dbcsr_tensor_split.mod dbcsr_tensor_block.mod dbcsr_tas_mm.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod dbcsr_tensor_reshape.mod dbcsr_array_list_methods.mod dbcsr_allocate_wrap.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor.mod' due to: dbcsr_tensor.o /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_tensor_types.mod dbcsr_data_types.mod dbcsr_tas_types.mod dbcsr_tensor_index.mod dbcsr_tensor_block.mod dbcsr_tensor_reshape.mod dbcsr_tas_base.mod dbcsr_tas_mm.mod dbcsr_tensor_split.mod dbcsr_dist_operations.mod dbcsr_allocate_wrap.mod dbcsr_base_hooks.mod dbcsr_toollib.mod dbcsr_tas_split.mod dbcsr_api.mod dbcsr_mpiwrap.mod dbcsr_tensor_io.mod dbcsr_array_list_methods.mod dbcsr_kinds.mod true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_test.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_test.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 dbcsr_tensor_types.mod dbcsr_data_types.mod dbcsr_tensor_block.mod dbcsr_tensor_index.mod dbcsr_kinds.mod dbcsr_tas_base.mod dbcsr_mpiwrap.mod dbcsr_tas_test.mod dbcsr_blas_operations.mod dbcsr_base_hooks.mod dbcsr_tensor.mod dbcsr_tensor_io.mod dbcsr_api.mod dbcsr_allocate_wrap.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_test.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_test.F /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/base/dbcsr_base_uses.f90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor.fypp dbcsr_data_types.mod dbcsr_tensor_types.mod dbcsr_api.mod dbcsr_tas_test.mod dbcsr_allocate_wrap.mod dbcsr_blas_operations.mod dbcsr_tensor_index.mod dbcsr_base_hooks.mod dbcsr_tensor_block.mod dbcsr_tensor_io.mod dbcsr_tas_base.mod dbcsr_tensor.mod dbcsr_kinds.mod dbcsr_mpiwrap.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_test.F dbcsr_tensor_test.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_test.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_test.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_test.F:103:18: @@ -1919,7 +1954,7 @@ note: '__result_blocks_equal' was declared here /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:284: update target 'dbcsr_tensor_test.mod' due to: dbcsr_tensor_test.o true -/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_api.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_api.F dbcsr_tensor_types.mod dbcsr_tensor_block.mod dbcsr_tensor_index.mod dbcsr_tensor_test.mod dbcsr_tensor_split.mod dbcsr_tensor.mod dbcsr_tensor_io.mod +/build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:280: update target 'dbcsr_tensor_api.o' due to: /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_api.F dbcsr_tensor_types.mod dbcsr_tensor_split.mod dbcsr_tensor_index.mod dbcsr_tensor_block.mod dbcsr_tensor_test.mod dbcsr_tensor_io.mod dbcsr_tensor.mod python3 /build/reproducible-path/cp2k-8.1/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/dbcsr_tensor_api.F dbcsr_tensor_api.F90 mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__SHORT_FILE__="\"dbcsr_tensor_api.F\"" -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src/tensors/' -I'/build/reproducible-path/cp2k-8.1/exts/dbcsr/src' dbcsr_tensor_api.F90 /build/reproducible-path/cp2k-8.1/exts/dbcsr/.cp2k/Makefile:329: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a' due to: dbcsr_work_operations.o dbcsr_machine_internal.o dbcsr_machine.o dbcsr_kinds.o dbcsr_base_hooks.o dbcsr_dist_util.o dbcsr_dist_operations.o dbcsr_dist_methods.o dbcsr_mpiwrap.o dbcsr_mp_operations.o dbcsr_mp_methods.o dbcsr_ptr_util.o dbcsr_mem_methods.o dbcsr_data_types.o dbcsr_data_operations.o dbcsr_data_methods_low.o dbcsr_data_methods.o dbcsr_acc_timings.o dbcsr_acc_stream.o dbcsr_acc_init.o dbcsr_acc_hostmem.o dbcsr_acc_event.o dbcsr_acc_devmem.o dbcsr_acc_device.o dbcsr_cuda_profiling.o dbcsr_hipblas.o dbcsr_types.o dbcsr_timings_types.o dbcsr_timings_report.o dbcsr_timings_base_type.o dbcsr_timings.o dbcsr_print_messages.o dbcsr_methods.o dbcsr_log_handling.o dbcsr_list_timerenv.o dbcsr_list_routinestat.o dbcsr_list_routinereport.o dbcsr_list_callstackentry.o dbcsr_list.o dbcsr_lib.o dbcsr_iter_types.o dbcsr_error_handling.o dbcsr_dict.o dbcsr_config.o dbcsr_array_types.o dbcsr_multiply_api.o dbcsr_mm_types.o dbcsr_mm_sched.o dbcsr_mm_multrec.o dbcsr_mm_hostdrv.o dbcsr_mm_dist_operations.o dbcsr_mm_csr.o dbcsr_mm_common.o dbcsr_mm_cannon.o dbcsr_mm_accdrv.o dbcsr_mm_3d.o dbcsr_mm.o dbcsr_acc_operations.o dbcsr_iterator_operations.o dbcsr_index_operations.o dbcsr_block_operations.o dbcsr_block_access.o dbcsr_toollib.o dbcsr_string_utilities.o dbcsr_min_heap.o dbcsr_files.o dbcsr_btree.o dbcsr_blas_operations.o dbcsr_array_sort.o dbcsr_transformations.o dbcsr_tests.o dbcsr_test_methods.o dbcsr_operations.o dbcsr_io.o dbcsr_csr_conversions.o dbcsr_tensor_types.o dbcsr_tensor_test.o dbcsr_tensor_split.o dbcsr_tensor_reshape.o dbcsr_tensor_io.o dbcsr_tensor_index.o dbcsr_tensor_block.o dbcsr_tensor_api.o dbcsr_tensor.o dbcsr_array_list_methods.o dbcsr_allocate_wrap.o dbcsr_api.o dbcsr_tas_util.o dbcsr_tas_types.o dbcsr_tas_test.o dbcsr_tas_split.o dbcsr_tas_reshape_ops.o dbcsr_tas_mm.o dbcsr_tas_io.o dbcsr_tas_global.o dbcsr_tas_base.o @@ -1931,12 +1966,12 @@ /usr/bin/make --no-print-directory -C /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp -f /build/reproducible-path/cp2k-8.1/Makefile all INCLUDE_DEPS=true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kinds.o' due to: /build/reproducible-path/cp2k-8.1/src/base/kinds.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/base/kinds.F kinds.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"base/kinds.F\"" -I'/build/reproducible-path/cp2k-8.1/src/base/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kinds.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:31:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"base/kinds.F\"" -I'/build/reproducible-path/cp2k-8.1/src/base/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kinds.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kinds.mod' due to: kinds.o /build/reproducible-path/cp2k-8.1/src/base/kinds.F true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'machine_internal.o' due to: /build/reproducible-path/cp2k-8.1/src/base/machine_internal.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/machine_posix.f90 kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/base/machine_internal.F machine_internal.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"base/machine_internal.F\"" -I'/build/reproducible-path/cp2k-8.1/src/base/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' machine_internal.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:31:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"base/machine_internal.F\"" -I'/build/reproducible-path/cp2k-8.1/src/base/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' machine_internal.F90 /build/reproducible-path/cp2k-8.1/src/base/machine_posix.f90:33:24: 33 | SUBROUTINE abort() BIND(C, name="abort") @@ -1974,83 +2009,48 @@ Warning: 'getpid' declared at (1) may shadow the intrinsic of the same name. In order to call the intrinsic, explicit INTRINSIC declarations may be required. [-Wintrinsic-shadow] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'machine_internal.mod' due to: machine_internal.o /build/reproducible-path/cp2k-8.1/src/base/machine_internal.F /build/reproducible-path/cp2k-8.1/src/base/machine_posix.f90 kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'machine.o' due to: /build/reproducible-path/cp2k-8.1/src/base/machine.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/machine_cpuid.h machine_internal.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'machine.o' due to: /build/reproducible-path/cp2k-8.1/src/base/machine.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/machine_cpuid.h kinds.mod machine_internal.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/base/machine.F machine.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"base/machine.F\"" -I'/build/reproducible-path/cp2k-8.1/src/base/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' machine.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'machine.mod' due to: machine.o /build/reproducible-path/cp2k-8.1/src/base/machine.F /build/reproducible-path/cp2k-8.1/src/base/machine_cpuid.h machine_internal.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:31:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"base/machine.F\"" -I'/build/reproducible-path/cp2k-8.1/src/base/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' machine.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'machine.mod' due to: machine.o /build/reproducible-path/cp2k-8.1/src/base/machine.F /build/reproducible-path/cp2k-8.1/src/base/machine_cpuid.h kinds.mod machine_internal.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'base_hooks.o' due to: /build/reproducible-path/cp2k-8.1/src/base/base_hooks.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod machine.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/base/base_hooks.F base_hooks.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"base/base_hooks.F\"" -I'/build/reproducible-path/cp2k-8.1/src/base/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' base_hooks.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:31:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"base/base_hooks.F\"" -I'/build/reproducible-path/cp2k-8.1/src/base/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' base_hooks.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'base_hooks.mod' due to: base_hooks.o /build/reproducible-path/cp2k-8.1/src/base/base_hooks.F machine.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'memory_utilities.o' due to: /build/reproducible-path/cp2k-8.1/src/common/memory_utilities.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'memory_utilities.o' due to: /build/reproducible-path/cp2k-8.1/src/common/memory_utilities.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/memory_utilities.F memory_utilities.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/memory_utilities.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' memory_utilities.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'memory_utilities.mod' due to: memory_utilities.o /build/reproducible-path/cp2k-8.1/src/common/memory_utilities.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:31:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/memory_utilities.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' memory_utilities.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'memory_utilities.mod' due to: memory_utilities.o /build/reproducible-path/cp2k-8.1/src/common/memory_utilities.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'memory_utilities_unittest.o' due to: /build/reproducible-path/cp2k-8.1/src/common/memory_utilities_unittest.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'memory_utilities_unittest.o' due to: /build/reproducible-path/cp2k-8.1/src/common/memory_utilities_unittest.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a memory_utilities.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/memory_utilities_unittest.F memory_utilities_unittest.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/memory_utilities_unittest.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' memory_utilities_unittest.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:31:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/memory_utilities_unittest.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' memory_utilities_unittest.F90 /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mathconstants.o' due to: /build/reproducible-path/cp2k-8.1/src/common/mathconstants.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/mathconstants.F mathconstants.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/mathconstants.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mathconstants.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/mathconstants.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mathconstants.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mathconstants.mod' due to: mathconstants.o /build/reproducible-path/cp2k-8.1/src/common/mathconstants.F kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'whittaker.o' due to: /build/reproducible-path/cp2k-8.1/src/common/whittaker.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'whittaker.o' due to: /build/reproducible-path/cp2k-8.1/src/common/whittaker.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/whittaker.F whittaker.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/whittaker.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' whittaker.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/whittaker.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' whittaker.F90 /build/reproducible-path/cp2k-8.1/src/common/whittaker.F:111:26: 111 | SUBROUTINE whittaker_c0(wc, r, expa, erfa, alpha, l, n) | ^ Warning: 'whittaker_c0' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_array_sort.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_array_sort.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/array_sort.fypp kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_array_sort.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_array_sort.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/array_sort.fypp base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cp_array_sort.F cp_array_sort.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_array_sort.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_array_sort.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_array_sort.mod' due to: cp_array_sort.o /build/reproducible-path/cp2k-8.1/src/common/cp_array_sort.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/array_sort.fypp kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_array_sort.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_array_sort.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_array_sort.mod' due to: cp_array_sort.o /build/reproducible-path/cp2k-8.1/src/common/cp_array_sort.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/array_sort.fypp base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'util.o' due to: /build/reproducible-path/cp2k-8.1/src/common/util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/common/sort_m.f90 cp_array_sort.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'util.o' due to: /build/reproducible-path/cp2k-8.1/src/common/util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/common/sort_m.f90 kinds.mod cp_array_sort.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/util.F util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'timings_base_type.o' due to: /build/reproducible-path/cp2k-8.1/src/common/timings_base_type.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/timings_base_type.F timings_base_type.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/timings_base_type.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' timings_base_type.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'timings_base_type.mod' due to: timings_base_type.o /build/reproducible-path/cp2k-8.1/src/common/timings_base_type.F kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'callgraph.o' due to: /build/reproducible-path/cp2k-8.1/src/common/callgraph.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/common/hash_map.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/callgraph.F callgraph.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/callgraph.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' callgraph.F90 -/build/reproducible-path/cp2k-8.1/src/common/callgraph.F:17:0: - - 17 | #:call hash_map(prefix='callgraph', & - | -Warning: 'callgraph_isready' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/common/callgraph.F:17:24: - - 17 | #:call hash_map(prefix='callgraph', & - | ^ -Warning: 'callgraph_del' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/common/callgraph.F:17:27: - - 17 | #:call hash_map(prefix='callgraph', & - | ^ -Warning: 'callgraph_update' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/common/callgraph.F:17:26: - - 17 | #:call hash_map(prefix='callgraph', & - | ^ -Warning: 'value' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/common/callgraph.F:17:66: - - 17 | #:call hash_map(prefix='callgraph', & - | ^ -note: 'value' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'callgraph.mod' due to: callgraph.o /build/reproducible-path/cp2k-8.1/src/common/callgraph.F /build/reproducible-path/cp2k-8.1/src/common/hash_map.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'routine_map.o' due to: /build/reproducible-path/cp2k-8.1/src/common/routine_map.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/common/hash_map.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'routine_map.o' due to: /build/reproducible-path/cp2k-8.1/src/common/routine_map.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/hash_map.fypp base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/routine_map.F routine_map.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:51 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/routine_map.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' routine_map.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/routine_map.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' routine_map.F90 /build/reproducible-path/cp2k-8.1/src/common/routine_map.F:16:0: 16 | #:call hash_map(prefix='routine_map', & @@ -2076,56 +2076,66 @@ 16 | #:call hash_map(prefix='routine_map', & | ^ note: 'value' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'routine_map.mod' due to: routine_map.o /build/reproducible-path/cp2k-8.1/src/common/routine_map.F /build/reproducible-path/cp2k-8.1/src/common/hash_map.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'routine_map.mod' due to: routine_map.o /build/reproducible-path/cp2k-8.1/src/common/routine_map.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/hash_map.fypp base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'list_callstackentry.o' due to: /build/reproducible-path/cp2k-8.1/src/common/list_callstackentry.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_base_type.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/list_callstackentry.F list_callstackentry.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list_callstackentry.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list_callstackentry.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'list_callstackentry.mod' due to: list_callstackentry.o /build/reproducible-path/cp2k-8.1/src/common/list_callstackentry.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_base_type.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'timings_base_type.o' due to: /build/reproducible-path/cp2k-8.1/src/common/timings_base_type.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/timings_base_type.F timings_base_type.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/timings_base_type.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' timings_base_type.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'timings_base_type.mod' due to: timings_base_type.o /build/reproducible-path/cp2k-8.1/src/common/timings_base_type.F kinds.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'list_routinestat.o' due to: /build/reproducible-path/cp2k-8.1/src/common/list_routinestat.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_base_type.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/list_routinestat.F list_routinestat.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list_routinestat.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list_routinestat.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list_routinestat.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list_routinestat.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'list_routinestat.mod' due to: list_routinestat.o /build/reproducible-path/cp2k-8.1/src/common/list_routinestat.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_base_type.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'timings_types.o' due to: /build/reproducible-path/cp2k-8.1/src/common/timings_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod callgraph.mod routine_map.mod list_callstackentry.mod list_routinestat.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'list_callstackentry.o' due to: /build/reproducible-path/cp2k-8.1/src/common/list_callstackentry.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_base_type.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/list_callstackentry.F list_callstackentry.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list_callstackentry.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list_callstackentry.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'list_callstackentry.mod' due to: list_callstackentry.o /build/reproducible-path/cp2k-8.1/src/common/list_callstackentry.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_base_type.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'callgraph.o' due to: /build/reproducible-path/cp2k-8.1/src/common/callgraph.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/hash_map.fypp timings_base_type.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/callgraph.F callgraph.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/callgraph.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' callgraph.F90 +/build/reproducible-path/cp2k-8.1/src/common/callgraph.F:17:0: + + 17 | #:call hash_map(prefix='callgraph', & + | +Warning: 'callgraph_isready' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/common/callgraph.F:17:24: + + 17 | #:call hash_map(prefix='callgraph', & + | ^ +Warning: 'callgraph_del' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/common/callgraph.F:17:27: + + 17 | #:call hash_map(prefix='callgraph', & + | ^ +Warning: 'callgraph_update' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/common/callgraph.F:17:26: + + 17 | #:call hash_map(prefix='callgraph', & + | ^ +Warning: 'value' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/common/callgraph.F:17:66: + + 17 | #:call hash_map(prefix='callgraph', & + | ^ +note: 'value' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'callgraph.mod' due to: callgraph.o /build/reproducible-path/cp2k-8.1/src/common/callgraph.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/hash_map.fypp timings_base_type.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'timings_types.o' due to: /build/reproducible-path/cp2k-8.1/src/common/timings_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod routine_map.mod list_routinestat.mod list_callstackentry.mod callgraph.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/timings_types.F timings_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/timings_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' timings_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/timings_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' timings_types.F90 /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_para_types.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_para_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cp_para_types.F cp_para_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_para_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_para_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_para_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_para_types.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_para_types.mod' due to: cp_para_types.o /build/reproducible-path/cp2k-8.1/src/common/cp_para_types.F true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'timings_types.mod' due to: timings_types.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cuda_profiling.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cuda_profiling.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cuda_profiling.F cuda_profiling.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cuda_profiling.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cuda_profiling.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cuda_profiling.mod' due to: cuda_profiling.o /build/reproducible-path/cp2k-8.1/src/common/cuda_profiling.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'list_timerenv.o' due to: /build/reproducible-path/cp2k-8.1/src/common/list_timerenv.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_types.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/list_timerenv.F list_timerenv.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list_timerenv.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list_timerenv.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'list_timerenv.mod' due to: list_timerenv.o /build/reproducible-path/cp2k-8.1/src/common/list_timerenv.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_types.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'list_routinereport.o' due to: /build/reproducible-path/cp2k-8.1/src/common/list_routinereport.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_base_type.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/list_routinereport.F list_routinereport.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list_routinereport.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list_routinereport.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'list_routinereport.mod' due to: list_routinereport.o /build/reproducible-path/cp2k-8.1/src/common/list_routinereport.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_base_type.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'list.o' due to: /build/reproducible-path/cp2k-8.1/src/common/list.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_base_type.mod list_timerenv.mod base_hooks.mod list_routinereport.mod list_routinestat.mod list_callstackentry.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/list.F list.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'list.mod' due to: list.o /build/reproducible-path/cp2k-8.1/src/common/list.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_base_type.mod list_timerenv.mod base_hooks.mod list_routinereport.mod list_routinestat.mod list_callstackentry.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'timings.o' due to: /build/reproducible-path/cp2k-8.1/src/common/timings.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod timings_types.mod callgraph.mod routine_map.mod cuda_profiling.mod base_hooks.mod machine.mod list.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/timings.F timings.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:37:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/timings.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' timings.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'timings.mod' due to: timings.o /build/reproducible-path/cp2k-8.1/src/common/timings.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod timings_types.mod callgraph.mod routine_map.mod cuda_profiling.mod base_hooks.mod machine.mod list.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'message_passing.o' due to: /build/reproducible-path/cp2k-8.1/src/mpiwrap/message_passing.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/mpiwrap/message_passing.f90 base_hooks.mod machine.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'message_passing.o' due to: /build/reproducible-path/cp2k-8.1/src/mpiwrap/message_passing.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/mpiwrap/message_passing.f90 kinds.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mpiwrap/message_passing.F message_passing.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:38:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mpiwrap/message_passing.F\"" -I'/build/reproducible-path/cp2k-8.1/src/mpiwrap/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' message_passing.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mpiwrap/message_passing.F\"" -I'/build/reproducible-path/cp2k-8.1/src/mpiwrap/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' message_passing.F90 /build/reproducible-path/cp2k-8.1/src/mpiwrap/message_passing.F:3358:33: 3358 | SUBROUTINE mp_file_read_at_chv(fh, offset, msg, msglen) @@ -2311,35 +2321,60 @@ 3784 | SUBROUTINE mp_file_read_at_${nametype1}$ (fh, offset, msg) | ^ Warning: 'mp_file_read_at_c' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'message_passing.mod' due to: message_passing.o /build/reproducible-path/cp2k-8.1/src/mpiwrap/message_passing.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/mpiwrap/message_passing.f90 base_hooks.mod machine.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'message_passing.mod' due to: message_passing.o /build/reproducible-path/cp2k-8.1/src/mpiwrap/message_passing.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/mpiwrap/message_passing.f90 kinds.mod machine.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_files.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_files.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 machine.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'util.mod' due to: util.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_files.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_files.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod machine.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cp_files.F cp_files.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:38:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_files.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_files.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_files.mod' due to: cp_files.o /build/reproducible-path/cp2k-8.1/src/common/cp_files.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 machine.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_files.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_files.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_files.mod' due to: cp_files.o /build/reproducible-path/cp2k-8.1/src/common/cp_files.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod machine.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'util.mod' due to: util.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cuda_profiling.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cuda_profiling.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cuda_profiling.F cuda_profiling.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cuda_profiling.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cuda_profiling.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cuda_profiling.mod' due to: cuda_profiling.o /build/reproducible-path/cp2k-8.1/src/common/cuda_profiling.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'list_routinereport.o' due to: /build/reproducible-path/cp2k-8.1/src/common/list_routinereport.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_base_type.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/list_routinereport.F list_routinereport.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list_routinereport.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list_routinereport.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'list_routinereport.mod' due to: list_routinereport.o /build/reproducible-path/cp2k-8.1/src/common/list_routinereport.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_base_type.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'timings_report.o' due to: /build/reproducible-path/cp2k-8.1/src/common/timings_report.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod cp_para_types.mod timings_types.mod callgraph.mod routine_map.mod timings.mod message_passing.mod base_hooks.mod list_routinereport.mod cp_files.mod util.mod list.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'list_timerenv.o' due to: /build/reproducible-path/cp2k-8.1/src/common/list_timerenv.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_types.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/list_timerenv.F list_timerenv.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list_timerenv.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list_timerenv.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'list_timerenv.mod' due to: list_timerenv.o /build/reproducible-path/cp2k-8.1/src/common/list_timerenv.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/list.fypp timings_types.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'list.o' due to: /build/reproducible-path/cp2k-8.1/src/common/list.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/common/list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod list_routinereport.mod list_callstackentry.mod list_routinestat.mod list_timerenv.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/list.F list.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/list.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' list.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'list.mod' due to: list.o /build/reproducible-path/cp2k-8.1/src/common/list.F /build/reproducible-path/cp2k-8.1/src/common/list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod list_routinereport.mod list_callstackentry.mod list_routinestat.mod list_timerenv.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'timings.o' due to: /build/reproducible-path/cp2k-8.1/src/common/timings.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod timings_types.mod routine_map.mod kinds.mod callgraph.mod cuda_profiling.mod list.mod machine.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/timings.F timings.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/timings.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' timings.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'timings.mod' due to: timings.o /build/reproducible-path/cp2k-8.1/src/common/timings.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 timings_base_type.mod timings_types.mod routine_map.mod kinds.mod callgraph.mod cuda_profiling.mod list.mod machine.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'timings_report.o' due to: /build/reproducible-path/cp2k-8.1/src/common/timings_report.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod timings_base_type.mod timings_types.mod message_passing.mod routine_map.mod util.mod kinds.mod cp_files.mod timings.mod list_routinereport.mod callgraph.mod list.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/timings_report.F timings_report.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:38:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/timings_report.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' timings_report.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 't_sh_p_s_c.o' due to: /build/reproducible-path/cp2k-8.1/src/common/t_sh_p_s_c.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/timings_report.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' timings_report.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 't_sh_p_s_c.o' due to: /build/reproducible-path/cp2k-8.1/src/common/t_sh_p_s_c.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/t_sh_p_s_c.F t_sh_p_s_c.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:38:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/t_sh_p_s_c.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' t_sh_p_s_c.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 't_c_g0.o' due to: /build/reproducible-path/cp2k-8.1/src/common/t_c_g0.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/t_sh_p_s_c.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' t_sh_p_s_c.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 't_c_g0.o' due to: /build/reproducible-path/cp2k-8.1/src/common/t_c_g0.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/t_c_g0.F t_c_g0.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:38:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/t_c_g0.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' t_c_g0.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'structure_factor_types.o' due to: /build/reproducible-path/cp2k-8.1/src/common/structure_factor_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/t_c_g0.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' t_c_g0.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'structure_factor_types.o' due to: /build/reproducible-path/cp2k-8.1/src/common/structure_factor_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/structure_factor_types.F structure_factor_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:38:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/structure_factor_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' structure_factor_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'structure_factor_types.mod' due to: structure_factor_types.o /build/reproducible-path/cp2k-8.1/src/common/structure_factor_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/structure_factor_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' structure_factor_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'structure_factor_types.mod' due to: structure_factor_types.o /build/reproducible-path/cp2k-8.1/src/common/structure_factor_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'structure_factors.o' due to: /build/reproducible-path/cp2k-8.1/src/common/structure_factors.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 structure_factor_types.mod mathconstants.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'structure_factors.o' due to: /build/reproducible-path/cp2k-8.1/src/common/structure_factors.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 structure_factor_types.mod base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/structure_factors.F structure_factors.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:38:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/structure_factors.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' structure_factors.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/structure_factors.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' structure_factors.F90 /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'string_utilities.o' due to: /build/reproducible-path/cp2k-8.1/src/common/string_utilities.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/string_utilities.F string_utilities.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:38:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/string_utilities.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' string_utilities.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:32:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/string_utilities.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' string_utilities.F90 /build/reproducible-path/cp2k-8.1/src/common/string_utilities.F:24:45: 24 | CHARACTER(LEN=1), PARAMETER :: backslash = '\\' @@ -2350,28 +2385,28 @@ 3168 | PURE FUNCTION s2a_60(s1, s2, s3, s4, s5, s6, s7, s8, s9, s10, & | ^ Warning: 's2a_60' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'string_table.o' due to: /build/reproducible-path/cp2k-8.1/src/common/string_table.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'string_table.o' due to: /build/reproducible-path/cp2k-8.1/src/common/string_table.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/string_table.F string_table.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:39:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/string_table.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' string_table.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:33:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/string_table.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' string_table.F90 /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lapack.o' due to: /build/reproducible-path/cp2k-8.1/src/common/lapack.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/lapack.F lapack.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:39:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/lapack.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lapack.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:33:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/lapack.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lapack.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lapack.mod' due to: lapack.o /build/reproducible-path/cp2k-8.1/src/common/lapack.F kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'splines.o' due to: /build/reproducible-path/cp2k-8.1/src/common/splines.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lapack.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'splines.o' due to: /build/reproducible-path/cp2k-8.1/src/common/splines.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod lapack.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/splines.F splines.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:39:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/splines.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' splines.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:33:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/splines.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' splines.F90 /build/reproducible-path/cp2k-8.1/src/common/splines.F:261:27: 261 | SUBROUTINE spline3valder(x, xi, c, val, der) | ^ Warning: 'spline3valder' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'spherical_harmonics.o' due to: /build/reproducible-path/cp2k-8.1/src/common/spherical_harmonics.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'spherical_harmonics.o' due to: /build/reproducible-path/cp2k-8.1/src/common/spherical_harmonics.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/spherical_harmonics.F spherical_harmonics.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:39:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/spherical_harmonics.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' spherical_harmonics.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'reference_manager.o' due to: /build/reproducible-path/cp2k-8.1/src/common/reference_manager.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod message_passing.mod util.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:33:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/spherical_harmonics.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' spherical_harmonics.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'reference_manager.o' due to: /build/reproducible-path/cp2k-8.1/src/common/reference_manager.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod message_passing.mod util.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/reference_manager.F reference_manager.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:39:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/reference_manager.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' reference_manager.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:33:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/reference_manager.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' reference_manager.F90 /build/reproducible-path/cp2k-8.1/src/common/reference_manager.F:721:40: 721 | res = thebib(key)%ref%citation_key @@ -2379,10 +2414,10 @@ Warning: CHARACTER expression will be truncated in assignment (80/128) at (1) [-Wcharacter-truncation] /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'print_messages.o' due to: /build/reproducible-path/cp2k-8.1/src/common/print_messages.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/print_messages.F print_messages.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:39:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/print_messages.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' print_messages.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'powell.o' due to: /build/reproducible-path/cp2k-8.1/src/common/powell.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:33:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/print_messages.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' print_messages.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'powell.o' due to: /build/reproducible-path/cp2k-8.1/src/common/powell.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/powell.F powell.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:39:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/powell.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' powell.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:33:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/powell.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' powell.F90 /build/reproducible-path/cp2k-8.1/src/common/powell.F:1608:34: 1608 | tempb = tempb - taumax @@ -2430,15 +2465,15 @@ note: 'bstep' was declared here /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'physcon.o' due to: /build/reproducible-path/cp2k-8.1/src/common/physcon.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/physcon.F physcon.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/physcon.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' physcon.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:33:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/physcon.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' physcon.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'string_utilities.mod' due to: string_utilities.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'periodic_table.o' due to: /build/reproducible-path/cp2k-8.1/src/common/periodic_table.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 string_utilities.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'periodic_table.o' due to: /build/reproducible-path/cp2k-8.1/src/common/periodic_table.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod string_utilities.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/periodic_table.F periodic_table.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/periodic_table.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' periodic_table.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'parallel_rng_types.o' due to: /build/reproducible-path/cp2k-8.1/src/common/parallel_rng_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 string_utilities.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:33:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/periodic_table.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' periodic_table.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'parallel_rng_types.o' due to: /build/reproducible-path/cp2k-8.1/src/common/parallel_rng_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod string_utilities.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/parallel_rng_types.F parallel_rng_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/parallel_rng_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' parallel_rng_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/parallel_rng_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' parallel_rng_types.F90 /build/reproducible-path/cp2k-8.1/src/common/parallel_rng_types.F:845:25: 845 | END FUNCTION next_real @@ -2449,9 +2484,9 @@ 804 | FUNCTION next_real(self, variance) RESULT(u) | ^ note: 'u' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mathlib.o' due to: /build/reproducible-path/cp2k-8.1/src/common/mathlib.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mathlib.o' due to: /build/reproducible-path/cp2k-8.1/src/common/mathlib.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/mathlib.F mathlib.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/mathlib.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mathlib.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/mathlib.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mathlib.F90 /build/reproducible-path/cp2k-8.1/src/common/mathlib.F:1484:3: 1484 | FUNCTION expint(n, x) @@ -2467,12 +2502,12 @@ 100 | FUNCTION pswitch(x, a, b, order) RESULT(fx) | ^ note: 'fx' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'linear_systems.o' due to: /build/reproducible-path/cp2k-8.1/src/common/linear_systems.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lapack.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'linear_systems.o' due to: /build/reproducible-path/cp2k-8.1/src/common/linear_systems.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod lapack.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/linear_systems.F linear_systems.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/linear_systems.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' linear_systems.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lebedev.o' due to: /build/reproducible-path/cp2k-8.1/src/common/lebedev.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/linear_systems.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' linear_systems.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lebedev.o' due to: /build/reproducible-path/cp2k-8.1/src/common/lebedev.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/lebedev.F lebedev.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/lebedev.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lebedev.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/lebedev.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lebedev.F90 /build/reproducible-path/cp2k-8.1/src/common/lebedev.F:146:42: 146 | END FUNCTION get_number_of_lebedev_grid @@ -2485,18 +2520,18 @@ note: 'number_of_lebedev_grid' was declared here /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kahan_sum.o' due to: /build/reproducible-path/cp2k-8.1/src/common/kahan_sum.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/kahan_sum.F kahan_sum.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/kahan_sum.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kahan_sum.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gamma.o' due to: /build/reproducible-path/cp2k-8.1/src/common/gamma.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/kahan_sum.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kahan_sum.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gamma.o' due to: /build/reproducible-path/cp2k-8.1/src/common/gamma.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/gamma.F gamma.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/gamma.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gamma.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/gamma.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gamma.F90 /build/reproducible-path/cp2k-8.1/src/common/gamma.F:281:22: 281 | SUBROUTINE fgamma_1(nmax, t, f) | ^ Warning: 'fgamma_1' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fparser.o' due to: /build/reproducible-path/cp2k-8.1/src/common/fparser.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fparser.o' due to: /build/reproducible-path/cp2k-8.1/src/common/fparser.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/fparser.F fparser.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/fparser.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fparser.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:24 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/fparser.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fparser.F90 /build/reproducible-path/cp2k-8.1/src/common/fparser.F:355:3: 355 | FUNCTION EvalErrMsg() RESULT(msg) @@ -2517,9 +2552,9 @@ 1027 | vals(ipar) = xval | ^ Warning: 'xval' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eigenvalueproblems.o' due to: /build/reproducible-path/cp2k-8.1/src/common/eigenvalueproblems.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lapack.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eigenvalueproblems.o' due to: /build/reproducible-path/cp2k-8.1/src/common/eigenvalueproblems.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod lapack.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/eigenvalueproblems.F eigenvalueproblems.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/eigenvalueproblems.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eigenvalueproblems.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:26 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/eigenvalueproblems.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eigenvalueproblems.F90 /build/reproducible-path/cp2k-8.1/src/common/eigenvalueproblems.F:146:25: 146 | SUBROUTINE cp2k_sgesvd(matrix, svalues, mrow, ncol, uvec, vtvec) @@ -2532,32 +2567,32 @@ Warning: 'cp2k_cgesvd' defined but not used [-Wunused-function] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'parallel_rng_types.mod' due to: parallel_rng_types.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_iter_types.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_iter_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_iter_types.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_iter_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cp_iter_types.F cp_iter_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_iter_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_iter_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_iter_types.mod' due to: cp_iter_types.o /build/reproducible-path/cp2k-8.1/src/common/cp_iter_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_iter_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_iter_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_iter_types.mod' due to: cp_iter_types.o /build/reproducible-path/cp2k-8.1/src/common/cp_iter_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_log_handling.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_log_handling.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_iter_types.mod string_utilities.mod timings.mod message_passing.mod base_hooks.mod cp_files.mod machine.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_log_handling.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_log_handling.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_iter_types.mod message_passing.mod kinds.mod cp_files.mod timings.mod string_utilities.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cp_log_handling.F cp_log_handling.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_log_handling.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_log_handling.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_log_handling.mod' due to: cp_log_handling.o /build/reproducible-path/cp2k-8.1/src/common/cp_log_handling.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_iter_types.mod string_utilities.mod timings.mod message_passing.mod base_hooks.mod cp_files.mod machine.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_log_handling.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_log_handling.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_log_handling.mod' due to: cp_log_handling.o /build/reproducible-path/cp2k-8.1/src/common/cp_log_handling.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_iter_types.mod message_passing.mod kinds.mod cp_files.mod timings.mod string_utilities.mod machine.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_array_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_array_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/cp_array_utils.fypp base_hooks.mod machine.mod kinds.mod cp_log_handling.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_array_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_array_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/common/cp_array_utils.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod machine.mod cp_log_handling.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cp_array_utils.F cp_array_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_array_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_array_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_array_utils.mod' due to: cp_array_utils.o /build/reproducible-path/cp2k-8.1/src/common/cp_array_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/cp_array_utils.fypp base_hooks.mod machine.mod kinds.mod cp_log_handling.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:29 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_array_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_array_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_array_utils.mod' due to: cp_array_utils.o /build/reproducible-path/cp2k-8.1/src/common/cp_array_utils.F /build/reproducible-path/cp2k-8.1/src/common/cp_array_utils.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod machine.mod cp_log_handling.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_para_env.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_para_env.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod message_passing.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_para_env.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_para_env.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod message_passing.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cp_para_env.F cp_para_env.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_para_env.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_para_env.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_para_env.mod' due to: cp_para_env.o /build/reproducible-path/cp2k-8.1/src/common/cp_para_env.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod message_passing.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_para_env.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_para_env.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_para_env.mod' due to: cp_para_env.o /build/reproducible-path/cp2k-8.1/src/common/cp_para_env.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod message_passing.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'distribution_1d_types.o' due to: /build/reproducible-path/cp2k-8.1/src/common/distribution_1d_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod base_hooks.mod cp_array_utils.mod cp_para_env.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'distribution_1d_types.o' due to: /build/reproducible-path/cp2k-8.1/src/common/distribution_1d_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod cp_array_utils.mod cp_para_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/distribution_1d_types.F distribution_1d_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/distribution_1d_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' distribution_1d_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'd3_poly.o' due to: /build/reproducible-path/cp2k-8.1/src/common/d3_poly.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/distribution_1d_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' distribution_1d_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'd3_poly.o' due to: /build/reproducible-path/cp2k-8.1/src/common/d3_poly.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/d3_poly.F d3_poly.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/d3_poly.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' d3_poly.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:32 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/d3_poly.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' d3_poly.F90 /build/reproducible-path/cp2k-8.1/src/common/d3_poly.F:235:3: 235 | PURE FUNCTION mono_index1(i) RESULT(res) @@ -2660,9 +2695,9 @@ Warning: 'poly_derive3' defined but not used [-Wunused-function] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'physcon.mod' due to: physcon.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_units.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_units.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 string_utilities.mod cp_log_handling.mod mathconstants.mod base_hooks.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_units.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_units.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod cp_log_handling.mod kinds.mod physcon.mod string_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cp_units.F cp_units.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_units.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_units.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_units.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_units.F90 /build/reproducible-path/cp2k-8.1/src/common/cp_units.F:443:31: 443 | desc = cp_unit_desc(unit) @@ -2673,14 +2708,14 @@ 1336 | SUBROUTINE cp_unit_set_retain(unit_set) | ^ Warning: 'cp_unit_set_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_result_types.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_result_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_result_types.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_result_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cp_result_types.F cp_result_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_result_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_result_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:40 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_result_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_result_types.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_result_types.mod' due to: cp_result_types.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_result_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_result_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_result_types.mod base_hooks.mod message_passing.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_result_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_result_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_result_types.mod message_passing.mod kinds.mod memory_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cp_result_methods.F cp_result_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:51 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_result_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_result_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_result_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_result_methods.F90 /build/reproducible-path/cp2k-8.1/src/common/cp_result_methods.F:271:17: 271 | CPASSERT(nrep*size_res == size_values) @@ -2691,9 +2726,9 @@ 199 | CPASSERT(nrep*size_res == size_values) | ^ Warning: 'size_res' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_min_heap.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_min_heap.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_min_heap.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_min_heap.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cp_min_heap.F cp_min_heap.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_min_heap.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_min_heap.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_min_heap.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_min_heap.F90 /build/reproducible-path/cp2k-8.1/src/common/cp_min_heap.F:73:3: 73 | ELEMENTAL FUNCTION get_right_child(n) RESULT(child) @@ -2706,24 +2741,24 @@ Warning: 'get_value_by_key' defined but not used [-Wunused-function] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'print_messages.mod' due to: print_messages.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_error_handling.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_error_handling.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod cp_log_handling.mod message_passing.mod base_hooks.mod timings.mod print_messages.mod machine.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_error_handling.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cp_error_handling.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod message_passing.mod cp_log_handling.mod kinds.mod timings.mod print_messages.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cp_error_handling.F cp_error_handling.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_error_handling.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_error_handling.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cp_error_handling.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_error_handling.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'spherical_harmonics.mod' due to: spherical_harmonics.o true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lebedev.mod' due to: lebedev.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cg_test.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cg_test.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 spherical_harmonics.mod cp_log_handling.mod mathconstants.mod base_hooks.mod machine.mod kinds.mod lebedev.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cg_test.o' due to: /build/reproducible-path/cp2k-8.1/src/common/cg_test.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod cp_log_handling.mod kinds.mod spherical_harmonics.mod lebedev.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/cg_test.F cg_test.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cg_test.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cg_test.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/cg_test.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cg_test.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'reference_manager.mod' due to: reference_manager.o true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'bibliography.o' due to: /build/reproducible-path/cp2k-8.1/src/common/bibliography.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 string_utilities.mod reference_manager.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/bibliography.F bibliography.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:40:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/bibliography.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bibliography.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'bessel_lib.o' due to: /build/reproducible-path/cp2k-8.1/src/common/bessel_lib.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/bibliography.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bibliography.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'bessel_lib.o' due to: /build/reproducible-path/cp2k-8.1/src/common/bessel_lib.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/bessel_lib.F bessel_lib.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/bessel_lib.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bessel_lib.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/bessel_lib.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bessel_lib.F90 /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a' due to: whittaker.o util.o timings_types.o timings_report.o timings_base_type.o timings.o t_sh_p_s_c.o t_c_g0.o structure_factors.o structure_factor_types.o string_utilities.o string_table.o splines.o spherical_harmonics.o routine_map.o reference_manager.o print_messages.o powell.o physcon.o periodic_table.o parallel_rng_types.o memory_utilities.o mathlib.o mathconstants.o list_timerenv.o list_routinestat.o list_routinereport.o list_callstackentry.o list.o linear_systems.o lebedev.o lapack.o kahan_sum.o gamma.o fparser.o eigenvalueproblems.o distribution_1d_types.o d3_poly.o cuda_profiling.o cp_units.o cp_result_types.o cp_result_methods.o cp_para_types.o cp_para_env.o cp_min_heap.o cp_log_handling.o cp_iter_types.o cp_files.o cp_error_handling.o cp_array_utils.o cp_array_sort.o cg_test.o callgraph.o bibliography.o bessel_lib.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a" Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a @@ -2742,49 +2777,41 @@ ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a machine_internal.o machine.o kinds.o base_hooks.o machine_cpuid.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:139: update target '/build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/memory_utilities_unittest.psmp' due to: memory_utilities_unittest.o /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a -mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/memory_utilities_unittest.psmp memory_utilities_unittest.o -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa +mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/memory_utilities_unittest.psmp memory_utilities_unittest.o -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'parallel_rng_types_unittest.o' due to: /build/reproducible-path/cp2k-8.1/src/common/parallel_rng_types_unittest.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a parallel_rng_types.mod message_passing.mod machine.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/common/parallel_rng_types_unittest.F parallel_rng_types_unittest.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/parallel_rng_types_unittest.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' parallel_rng_types_unittest.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"common/parallel_rng_types_unittest.F\"" -I'/build/reproducible-path/cp2k-8.1/src/common/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' parallel_rng_types_unittest.F90 /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:135: update target '/build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/parallel_rng_types_unittest.psmp' due to: parallel_rng_types_unittest.o /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a -mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/parallel_rng_types_unittest.psmp parallel_rng_types_unittest.o -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_miniapp.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/grid_miniapp.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/grid_replay.h +mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:34:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/parallel_rng_types_unittest.psmp parallel_rng_types_unittest.o -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_miniapp.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/grid_miniapp.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/grid_replay.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/grid_miniapp.c -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_grid_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_grid_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/pw_grid_types.F pw_grid_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:10 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_grid_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_grid_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_grid_types.mod' due to: pw_grid_types.o /build/reproducible-path/cp2k-8.1/src/pw/pw_grid_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mathlib.mod' due to: mathlib.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fast.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fast.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod mathconstants.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/fast.F fast.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fast.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fast.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fast.mod' due to: fast.o /build/reproducible-path/cp2k-8.1/src/pw/fast.F mathconstants.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_units.mod' due to: cp_units.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cell_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/cell_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathlib.mod cp_units.mod mathconstants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/cell_types.F cell_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:35:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/cell_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cell_types.mod' due to: cell_types.o /build/reproducible-path/cp2k-8.1/src/subsys/cell_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathlib.mod cp_units.mod mathconstants.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_grid_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_grid_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/pw_grid_types.F pw_grid_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:35:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_grid_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_grid_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_grid_types.mod' due to: pw_grid_types.o /build/reproducible-path/cp2k-8.1/src/pw/pw_grid_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fft_kinds.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fft/fft_kinds.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/fft/fft_kinds.F fft_kinds.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fft_kinds.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/fft/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fft_kinds.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:35:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fft_kinds.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/fft/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fft_kinds.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fft_kinds.mod' due to: fft_kinds.o /build/reproducible-path/cp2k-8.1/src/pw/fft/fft_kinds.F true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fft_plan.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fft/fft_plan.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod fft_kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/fft/fft_plan.F fft_plan.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fft_plan.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/fft/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fft_plan.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:35:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fft_plan.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/fft/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fft_plan.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fft_plan.mod' due to: fft_plan.o /build/reproducible-path/cp2k-8.1/src/pw/fft/fft_plan.F fft_kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mltfftsg_tools.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fft/mltfftsg_tools.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod fft_kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/fft/mltfftsg_tools.F mltfftsg_tools.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/mltfftsg_tools.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/fft/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mltfftsg_tools.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mltfftsg_tools.mod' due to: mltfftsg_tools.o /build/reproducible-path/cp2k-8.1/src/pw/fft/mltfftsg_tools.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod fft_kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fftsg_lib.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fft/fftsg_lib.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod mltfftsg_tools.mod fft_kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/fft/fftsg_lib.F fftsg_lib.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fftsg_lib.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/fft/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fftsg_lib.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fftsg_lib.mod' due to: fftsg_lib.o /build/reproducible-path/cp2k-8.1/src/pw/fft/fftsg_lib.F mltfftsg_tools.mod fft_kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fftw3_lib.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fft/fftw3_lib.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod fft_kinds.mod cp_files.mod fft_plan.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fftw3_lib.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fft/fftw3_lib.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_files.mod fft_kinds.mod fft_plan.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/fft/fftw3_lib.F fftw3_lib.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fftw3_lib.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/fft/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fftw3_lib.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:35:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fftw3_lib.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/fft/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fftw3_lib.F90 /build/reproducible-path/cp2k-8.1/src/pw/fft/fftw3_lib.F:1077:71: 1077 | scal_offset @@ -2800,31 +2827,46 @@ 1076 | INTEGER :: in_offset, my_id, num_rows, out_offset, & | ^ note: 'num_rows' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fftw3_lib.mod' due to: fftw3_lib.o /build/reproducible-path/cp2k-8.1/src/pw/fft/fftw3_lib.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod fft_kinds.mod cp_files.mod fft_plan.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fftw3_lib.mod' due to: fftw3_lib.o /build/reproducible-path/cp2k-8.1/src/pw/fft/fftw3_lib.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_files.mod fft_kinds.mod fft_plan.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mltfftsg_tools.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fft/mltfftsg_tools.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod fft_kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/fft/mltfftsg_tools.F mltfftsg_tools.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:35:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/mltfftsg_tools.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/fft/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mltfftsg_tools.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mltfftsg_tools.mod' due to: mltfftsg_tools.o /build/reproducible-path/cp2k-8.1/src/pw/fft/mltfftsg_tools.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod fft_kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fftsg_lib.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fft/fftsg_lib.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod mltfftsg_tools.mod fft_kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/fft/fftsg_lib.F fftsg_lib.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:35:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fftsg_lib.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/fft/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fftsg_lib.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fftsg_lib.mod' due to: fftsg_lib.o /build/reproducible-path/cp2k-8.1/src/pw/fft/fftsg_lib.F mltfftsg_tools.mod fft_kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fft_lib.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fft/fft_lib.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod fft_kinds.mod fftsg_lib.mod fft_plan.mod fftw3_lib.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fft_lib.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fft/fft_lib.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fftw3_lib.mod fftsg_lib.mod fft_kinds.mod fft_plan.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/fft/fft_lib.F fft_lib.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fft_lib.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/fft/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fft_lib.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fft_lib.mod' due to: fft_lib.o /build/reproducible-path/cp2k-8.1/src/pw/fft/fft_lib.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod fft_kinds.mod fftsg_lib.mod fft_plan.mod fftw3_lib.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:35:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft/fft_lib.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/fft/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fft_lib.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fft_lib.mod' due to: fft_lib.o /build/reproducible-path/cp2k-8.1/src/pw/fft/fft_lib.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fftw3_lib.mod fftsg_lib.mod fft_kinds.mod fft_plan.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fast.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fast.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod mathconstants.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/fast.F fast.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:35:26 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fast.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fast.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fast.mod' due to: fast.o /build/reproducible-path/cp2k-8.1/src/pw/fast.F mathconstants.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fft_tools.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fft_tools.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_log_handling.mod message_passing.mod fast.mod base_hooks.mod kinds.mod fft_plan.mod fft_lib.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fft_tools.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fft_tools.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod message_passing.mod cp_log_handling.mod kinds.mod fft_lib.mod fast.mod fft_plan.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/fft_tools.F fft_tools.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:32 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft_tools.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fft_tools.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:35:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/fft_tools.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fft_tools.F90 /build/reproducible-path/cp2k-8.1/src/pw/fft_tools.F:3286:64: 3286 | fft_scratch_last%fft_scratch_next => fft_scratch_new | ^ Warning: 'fft_scratch_last' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fft_tools.mod' due to: fft_tools.o /build/reproducible-path/cp2k-8.1/src/pw/fft_tools.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_log_handling.mod message_passing.mod fast.mod base_hooks.mod kinds.mod fft_plan.mod fft_lib.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fft_tools.mod' due to: fft_tools.o /build/reproducible-path/cp2k-8.1/src/pw/fft_tools.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod message_passing.mod cp_log_handling.mod kinds.mod fft_lib.mod fast.mod fft_plan.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_grid_info.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_grid_info.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod base_hooks.mod mathconstants.mod fft_tools.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_grid_info.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_grid_info.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod mathconstants.mod kinds.mod fft_tools.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/pw_grid_info.F pw_grid_info.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_grid_info.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_grid_info.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_grid_info.mod' due to: pw_grid_info.o /build/reproducible-path/cp2k-8.1/src/pw/pw_grid_info.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod base_hooks.mod mathconstants.mod fft_tools.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:35:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_grid_info.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_grid_info.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_grid_info.mod' due to: pw_grid_info.o /build/reproducible-path/cp2k-8.1/src/pw/pw_grid_info.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod mathconstants.mod kinds.mod fft_tools.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_grids.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_grids.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod mathlib.mod base_hooks.mod mathconstants.mod message_passing.mod pw_grid_info.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_grids.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_grids.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod message_passing.mod mathlib.mod util.mod mathconstants.mod kinds.mod pw_grid_info.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/pw_grids.F pw_grids.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:51 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_grids.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_grids.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:35:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_grids.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_grids.F90 /build/reproducible-path/cp2k-8.1/src/pw/pw_grids.F:1429:29: 1429 | DO n = nlim(1), nlim(2) @@ -2851,23 +2893,23 @@ 1400 | INTEGER :: l, m, mm, n, n_upperlimit, nlim(2), nn | ^ note: 'n_upperlimit' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_grids.mod' due to: pw_grids.o /build/reproducible-path/cp2k-8.1/src/pw/pw_grids.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod mathlib.mod base_hooks.mod mathconstants.mod message_passing.mod pw_grid_info.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_grids.mod' due to: pw_grids.o /build/reproducible-path/cp2k-8.1/src/pw/pw_grids.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod message_passing.mod mathlib.mod util.mod mathconstants.mod kinds.mod pw_grid_info.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod timings.mod cp_log_handling.mod base_hooks.mod pw_grids.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod cp_log_handling.mod kinds.mod timings.mod pw_grids.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/pw_types.F pw_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_types.mod' due to: pw_types.o /build/reproducible-path/cp2k-8.1/src/pw/pw_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod timings.mod cp_log_handling.mod base_hooks.mod pw_grids.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_fpga.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_fpga.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_files.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/pw_fpga.F pw_fpga.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_fpga.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_fpga.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_fpga.mod' due to: pw_fpga.o /build/reproducible-path/cp2k-8.1/src/pw/pw_fpga.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_files.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:36:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_types.mod' due to: pw_types.o /build/reproducible-path/cp2k-8.1/src/pw/pw_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod cp_log_handling.mod kinds.mod timings.mod pw_grids.mod base_hooks.mod true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kahan_sum.mod' due to: kahan_sum.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_cuda.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_cuda.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_grid_types.mod base_hooks.mod message_passing.mod fast.mod kinds.mod fft_tools.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_fpga.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_fpga.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_files.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/pw_fpga.F pw_fpga.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:36:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_fpga.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_fpga.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_fpga.mod' due to: pw_fpga.o /build/reproducible-path/cp2k-8.1/src/pw/pw_fpga.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_files.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_cuda.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_cuda.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod message_passing.mod kinds.mod fast.mod fft_tools.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/pw_cuda.F pw_cuda.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_cuda.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_cuda.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:36:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_cuda.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_cuda.F90 /build/reproducible-path/cp2k-8.1/src/pw/pw_cuda.F:770:25: 770 | SUBROUTINE pw_cuda_cff(pw1, pwbuf) @@ -2903,11 +2945,11 @@ 1029 | SUBROUTINE pw_cuda_sf(pw1, pwbuf, scale) | ^ Warning: 'pw_cuda_sf' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_cuda.mod' due to: pw_cuda.o /build/reproducible-path/cp2k-8.1/src/pw/pw_cuda.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_grid_types.mod base_hooks.mod message_passing.mod fast.mod kinds.mod fft_tools.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_cuda.mod' due to: pw_cuda.o /build/reproducible-path/cp2k-8.1/src/pw/pw_cuda.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod message_passing.mod kinds.mod fast.mod fft_tools.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod cp_log_handling.mod message_passing.mod fast.mod base_hooks.mod pw_fpga.mod kahan_sum.mod pw_cuda.mod machine.mod kinds.mod fft_tools.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod message_passing.mod kahan_sum.mod cp_log_handling.mod kinds.mod pw_fpga.mod fast.mod fft_tools.mod machine.mod pw_cuda.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/pw_methods.F pw_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:41:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:36:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_methods.F90 /build/reproducible-path/cp2k-8.1/src/pw/pw_methods.F:1837:30: 1837 | pw2%in_space = out_space @@ -2923,85 +2965,78 @@ 2051 | integral_value = integral_value*pw1%pw_grid%vol | ^ Warning: 'integral_value' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_methods.mod' due to: pw_methods.o /build/reproducible-path/cp2k-8.1/src/pw/pw_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod cp_log_handling.mod message_passing.mod fast.mod base_hooks.mod pw_fpga.mod kahan_sum.mod pw_cuda.mod machine.mod kinds.mod fft_tools.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_methods.mod' due to: pw_methods.o /build/reproducible-path/cp2k-8.1/src/pw/pw_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod message_passing.mod kahan_sum.mod cp_log_handling.mod kinds.mod pw_fpga.mod fast.mod fft_tools.mod machine.mod pw_cuda.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'realspace_grid_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/realspace_grid_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_grid_types.mod mathlib.mod cp_log_handling.mod message_passing.mod fast.mod pw_methods.mod base_hooks.mod pw_grids.mod cp_array_utils.mod machine.mod util.mod kinds.mod kahan_sum.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'realspace_grid_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/realspace_grid_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod mathlib.mod message_passing.mod util.mod kahan_sum.mod cp_log_handling.mod kinds.mod cp_array_utils.mod pw_grids.mod pw_methods.mod fast.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/realspace_grid_types.F realspace_grid_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:42:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/realspace_grid_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' realspace_grid_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'realspace_grid_types.mod' due to: realspace_grid_types.o /build/reproducible-path/cp2k-8.1/src/pw/realspace_grid_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_grid_types.mod mathlib.mod cp_log_handling.mod message_passing.mod fast.mod pw_methods.mod base_hooks.mod pw_grids.mod cp_array_utils.mod machine.mod util.mod kinds.mod kahan_sum.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_units.mod' due to: cp_units.o +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:36:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/realspace_grid_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' realspace_grid_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'realspace_grid_types.mod' due to: realspace_grid_types.o /build/reproducible-path/cp2k-8.1/src/pw/realspace_grid_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod mathlib.mod message_passing.mod util.mod kahan_sum.mod cp_log_handling.mod kinds.mod cp_array_utils.mod pw_grids.mod pw_methods.mod fast.mod machine.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cell_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/cell_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathlib.mod base_hooks.mod mathconstants.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/cell_types.F cell_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:42:10 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/cell_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cell_types.mod' due to: cell_types.o /build/reproducible-path/cp2k-8.1/src/subsys/cell_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathlib.mod base_hooks.mod mathconstants.mod cp_units.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cube_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/cube_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod base_hooks.mod kinds.mod mathlib.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cube_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/cube_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod mathlib.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/cube_utils.F cube_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:42:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/cube_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cube_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cube_utils.mod' due to: cube_utils.o /build/reproducible-path/cp2k-8.1/src/pw/cube_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod base_hooks.mod kinds.mod mathlib.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:36:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/cube_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cube_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cube_utils.mod' due to: cube_utils.o /build/reproducible-path/cp2k-8.1/src/pw/cube_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod mathlib.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'grid_api.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/grid_api.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod cell_types.mod message_passing.mod base_hooks.mod cube_utils.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'grid_api.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/grid_api.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod realspace_grid_types.mod message_passing.mod cube_utils.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/grid/grid_api.F grid_api.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:42:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"grid/grid_api.F\"" -I'/build/reproducible-path/cp2k-8.1/src/grid/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' grid_api.F90 -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_task_list.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/grid_task_list.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/grid_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/gpu/grid_gpu_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/hybrid/grid_hybrid_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:36:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"grid/grid_api.F\"" -I'/build/reproducible-path/cp2k-8.1/src/grid/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' grid_api.F90 +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_task_list.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/grid_task_list.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/gpu/grid_gpu_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/hybrid/grid_hybrid_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/grid_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/grid_task_list.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_replay.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/grid_replay.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/grid_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_integrate.h /build/reproducible-path/cp2k-8.1/src/grid/hybrid/grid_hybrid_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/gpu/grid_gpu_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_collocate.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/grid_replay.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_replay.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/grid_replay.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/gpu/grid_gpu_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/hybrid/grid_hybrid_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_integrate.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_collocate.h /build/reproducible-path/cp2k-8.1/src/grid/grid_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/grid_replay.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/grid_replay.c /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a' due to: grid_api.o grid_task_list.o grid_replay.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a" Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a grid_api.o grid_task_list.o grid_replay.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_integrate_hybrid.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/hybrid/grid_integrate_hybrid.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_context_cpu.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/hybrid/grid_hybrid_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/coefficients.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_integrate_hybrid.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/hybrid/grid_integrate_hybrid.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/coefficients.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/hybrid/grid_hybrid_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_context_cpu.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/hybrid/grid_integrate_hybrid.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_collocate_hybrid.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/hybrid/grid_collocate_hybrid.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_context_cpu.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/coefficients.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_collocate_hybrid.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/hybrid/grid_collocate_hybrid.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/coefficients.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_context_cpu.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/hybrid/grid_collocate_hybrid.c /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a' due to: grid_integrate_hybrid.o grid_collocate_hybrid.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a" Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a grid_integrate_hybrid.o grid_collocate_hybrid.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'utils.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'utils.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'tensor_local.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'tensor_local.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'non_orthorombic_corrections.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'non_orthorombic_corrections.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_prepare_pab_dgemm.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_prepare_pab_dgemm.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_integrate_dgemm.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_integrate_dgemm.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/coefficients.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_integrate_dgemm.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_integrate_dgemm.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/coefficients.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_integrate_dgemm.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_context_cpu.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_context_cpu.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_context_cpu.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_context_cpu.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_context_cpu.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_context_cpu.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_context_cpu.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_collocate_dgemm.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/coefficients.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_collocate_dgemm.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/coefficients.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_cpu_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_prepare_pab_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/cpu/grid_collocate_dgemm.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'collocation_integration.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'collocation_integration.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/non_orthorombic_corrections.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/cpu/collocation_integration.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'coefficients.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/coefficients.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/coefficients.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'coefficients.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/cpu/coefficients.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/cpu/coefficients.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/utils.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/tensor_local.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/cpu/cpu_private_header.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/cpu/coefficients.c /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a' due to: utils.o tensor_local.o non_orthorombic_corrections.o grid_prepare_pab_dgemm.o grid_integrate_dgemm.o grid_context_cpu.o grid_collocate_dgemm.o collocation_integration.o coefficients.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a" Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a utils.o tensor_local.o non_orthorombic_corrections.o grid_prepare_pab_dgemm.o grid_integrate_dgemm.o grid_context_cpu.o grid_collocate_dgemm.o collocation_integration.o coefficients.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_ref_task_list.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_task_list.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_collocate.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_integrate.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_ref_task_list.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_task_list.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_basis_set.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_integrate.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_collocate.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_task_list.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_task_list.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_ref_prepare_pab.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_prepare_pab.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_prepare_pab.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_prepare_pab.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_ref_prepare_pab.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_prepare_pab.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_prepare_pab.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_prepare_pab.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_prepare_pab.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_ref_integrate.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_integrate.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_collint.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_integrate.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_ref_integrate.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_integrate.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_integrate.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_collint.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_integrate.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_ref_collocate.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_collocate.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_collint.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_collocate.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_prepare_pab.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_integrate.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_ref_collocate.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_collocate.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_integrate.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_collocate.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_collint.h /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_prepare_pab.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/ref/grid_ref_collocate.c /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a' due to: grid_ref_task_list.o grid_ref_prepare_pab.o grid_ref_integrate.o grid_ref_collocate.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a" Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a grid_ref_task_list.o grid_ref_prepare_pab.o grid_ref_integrate.o grid_ref_collocate.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_sphere_cache.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_sphere_cache.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_library.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_library.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_common.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.c /build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_buffer.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/common/grid_buffer.c @@ -3012,77 +3047,72 @@ Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a grid_sphere_cache.o grid_library.o grid_buffer.o grid_basis_set.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'virial_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/virial_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'virial_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/virial_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/virial_types.F virial_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:42:51 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/virial_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' virial_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'shell_potential_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/shell_potential_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/virial_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' virial_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'shell_potential_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/shell_potential_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/shell_potential_types.F shell_potential_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:42:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/shell_potential_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' shell_potential_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/shell_potential_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' shell_potential_types.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'shell_potential_types.mod' due to: shell_potential_types.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'damping_dipole_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/damping_dipole_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/damping_dipole_types.F damping_dipole_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:42:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/damping_dipole_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' damping_dipole_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'damping_dipole_types.mod' due to: damping_dipole_types.o /build/reproducible-path/cp2k-8.1/src/subsys/damping_dipole_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_inpp_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_inpp_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/cp_parser_inpp_types.F cp_parser_inpp_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_inpp_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_inpp_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_inpp_types.mod' due to: cp_parser_inpp_types.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_inpp_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_buffer_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_buffer_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/cp_parser_buffer_types.F cp_parser_buffer_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_buffer_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_buffer_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_buffer_types.mod' due to: cp_parser_buffer_types.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_buffer_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_ilist_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_ilist_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/cp_parser_ilist_types.F cp_parser_ilist_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:42:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_ilist_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_ilist_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_ilist_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_ilist_types.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_ilist_types.mod' due to: cp_parser_ilist_types.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_ilist_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_inpp_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_inpp_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/cp_parser_inpp_types.F cp_parser_inpp_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:42:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_inpp_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_inpp_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_inpp_types.mod' due to: cp_parser_inpp_types.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_inpp_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_buffer_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_buffer_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/cp_parser_buffer_types.F cp_parser_buffer_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:42:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_buffer_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_buffer_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_buffer_types.mod' due to: cp_parser_buffer_types.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_buffer_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_status_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_status_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_buffer_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_status_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_status_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_buffer_types.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/cp_parser_status_types.F cp_parser_status_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:42:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_status_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_status_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_status_types.mod' due to: cp_parser_status_types.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_status_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_buffer_types.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_status_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_status_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_status_types.mod' due to: cp_parser_status_types.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_status_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_buffer_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_ilist_types.mod cp_para_types.mod cp_parser_inpp_types.mod cp_parser_buffer_types.mod cp_parser_status_types.mod string_utilities.mod message_passing.mod base_hooks.mod cp_files.mod cp_para_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_inpp_types.mod cp_parser_buffer_types.mod cp_parser_ilist_types.mod cp_parser_status_types.mod message_passing.mod cp_files.mod kinds.mod string_utilities.mod cp_para_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/cp_parser_types.F cp_parser_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:42:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_types.F90 /build/reproducible-path/cp2k-8.1/src/input/cp_parser_types.F:110:27: 110 | SUBROUTINE parser_retain(parser) | ^ Warning: 'parser_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_types.mod' due to: cp_parser_types.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_ilist_types.mod cp_para_types.mod cp_parser_inpp_types.mod cp_parser_buffer_types.mod cp_parser_status_types.mod string_utilities.mod message_passing.mod base_hooks.mod cp_files.mod cp_para_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_types.mod' due to: cp_parser_types.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_inpp_types.mod cp_parser_buffer_types.mod cp_parser_ilist_types.mod cp_parser_status_types.mod message_passing.mod cp_files.mod kinds.mod string_utilities.mod cp_para_env.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_enumeration_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/input_enumeration_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod string_utilities.mod kinds.mod cp_log_handling.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_enumeration_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/input_enumeration_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod string_utilities.mod cp_log_handling.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/input_enumeration_types.F input_enumeration_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:42:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_enumeration_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_enumeration_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_enumeration_types.mod' due to: input_enumeration_types.o /build/reproducible-path/cp2k-8.1/src/input/input_enumeration_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod string_utilities.mod kinds.mod cp_log_handling.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_enumeration_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_enumeration_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_enumeration_types.mod' due to: input_enumeration_types.o /build/reproducible-path/cp2k-8.1/src/input/input_enumeration_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod string_utilities.mod cp_log_handling.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_val_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/input_val_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod input_enumeration_types.mod base_hooks.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_val_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/input_val_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod input_enumeration_types.mod cp_units.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/input_val_types.F input_val_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_val_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_val_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_val_types.mod' due to: input_val_types.o /build/reproducible-path/cp2k-8.1/src/input/input_val_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod input_enumeration_types.mod base_hooks.mod cp_units.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_val_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_val_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_val_types.mod' due to: input_val_types.o /build/reproducible-path/cp2k-8.1/src/input/input_val_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod input_enumeration_types.mod cp_units.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_keyword_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/input_keyword_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_enumeration_types.mod string_utilities.mod base_hooks.mod reference_manager.mod print_messages.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_keyword_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/input_keyword_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_enumeration_types.mod kinds.mod base_hooks.mod print_messages.mod string_utilities.mod reference_manager.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/input_keyword_types.F input_keyword_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_keyword_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_keyword_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_keyword_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_keyword_types.F90 /build/reproducible-path/cp2k-8.1/src/input/input_keyword_types.F:542:83: 542 | c_string = cp_unit_desc(keyword%unit, accept_undefined=.TRUE.) | 1 Warning: CHARACTER expression will be truncated in assignment (80/120) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_keyword_types.mod' due to: input_keyword_types.o /build/reproducible-path/cp2k-8.1/src/input/input_keyword_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_enumeration_types.mod string_utilities.mod base_hooks.mod reference_manager.mod print_messages.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_keyword_types.mod' due to: input_keyword_types.o /build/reproducible-path/cp2k-8.1/src/input/input_keyword_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_enumeration_types.mod kinds.mod base_hooks.mod print_messages.mod string_utilities.mod reference_manager.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_linked_list_input.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_linked_list_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/common/cp_linked_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_linked_list_input.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_linked_list_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/common/cp_linked_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/cp_linked_list_input.F cp_linked_list_input.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_linked_list_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_linked_list_input.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_linked_list_input.mod' due to: cp_linked_list_input.o /build/reproducible-path/cp2k-8.1/src/input/cp_linked_list_input.F /build/reproducible-path/cp2k-8.1/src/common/cp_linked_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_linked_list_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_linked_list_input.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_linked_list_input.mod' due to: cp_linked_list_input.o /build/reproducible-path/cp2k-8.1/src/input/cp_linked_list_input.F /build/reproducible-path/cp2k-8.1/src/common/cp_linked_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_section_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/input_section_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod reference_manager.mod print_messages.mod cp_linked_list_input.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_section_types.o' due to: /build/reproducible-path/cp2k-8.1/src/input/input_section_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod cp_log_handling.mod cp_linked_list_input.mod kinds.mod print_messages.mod string_utilities.mod reference_manager.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/input_section_types.F input_section_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_section_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_section_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_section_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_section_types.F90 /build/reproducible-path/cp2k-8.1/src/input/input_section_types.F:904:3: 904 | FUNCTION section_get_cval(section_vals, keyword_name) RESULT(res) @@ -3093,13 +3123,16 @@ 936 | FUNCTION section_get_rvals(section_vals, keyword_name) RESULT(res) | ^ Warning: 'section_get_rvals' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_section_types.mod' due to: input_section_types.o /build/reproducible-path/cp2k-8.1/src/input/input_section_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod reference_manager.mod print_messages.mod cp_linked_list_input.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_section_types.mod' due to: input_section_types.o /build/reproducible-path/cp2k-8.1/src/input/input_section_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod cp_log_handling.mod cp_linked_list_input.mod kinds.mod print_messages.mod string_utilities.mod reference_manager.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'periodic_table.mod' due to: periodic_table.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'orbital_pointers.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_pointers.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_pointers.F orbital_pointers.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/orbital_pointers.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' orbital_pointers.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'orbital_pointers.mod' due to: orbital_pointers.o /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_pointers.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'orbital_symbols.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_symbols.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_symbols.F orbital_symbols.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/orbital_symbols.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' orbital_symbols.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/orbital_symbols.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' orbital_symbols.F90 /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_symbols.F:126:31: 126 | symbol(i:i) = l_sym(l) @@ -3107,19 +3140,14 @@ Warning: 'i' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'orbital_symbols.mod' due to: orbital_symbols.o /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_symbols.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'orbital_pointers.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_pointers.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_pointers.F orbital_pointers.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/orbital_pointers.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' orbital_pointers.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'orbital_pointers.mod' due to: orbital_pointers.o /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_pointers.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'orbital_transformation_matrices.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_transformation_matrices.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathlib.mod base_hooks.mod mathconstants.mod orbital_symbols.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'orbital_transformation_matrices.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_transformation_matrices.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathlib.mod mathconstants.mod kinds.mod orbital_pointers.mod orbital_symbols.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_transformation_matrices.F orbital_transformation_matrices.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/orbital_transformation_matrices.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' orbital_transformation_matrices.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'orbital_transformation_matrices.mod' due to: orbital_transformation_matrices.o /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_transformation_matrices.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathlib.mod base_hooks.mod mathconstants.mod orbital_symbols.mod orbital_pointers.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/orbital_transformation_matrices.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' orbital_transformation_matrices.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'orbital_transformation_matrices.mod' due to: orbital_transformation_matrices.o /build/reproducible-path/cp2k-8.1/src/aobasis/orbital_transformation_matrices.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathlib.mod mathconstants.mod kinds.mod orbital_pointers.mod orbital_symbols.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ao_util.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ao_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod orbital_transformation_matrices.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ao_util.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ao_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod orbital_pointers.mod orbital_transformation_matrices.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ao_util.F ao_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ao_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ao_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ao_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ao_util.F90 /build/reproducible-path/cp2k-8.1/src/aobasis/ao_util.F:472:27: 472 | SUBROUTINE transform_c2s(CPC_co, CPC_so, maxl, lm1, lm2) @@ -3150,13 +3178,13 @@ 197 | r = MAX(SQRT(0.5_dp*REAL(l, dp)/a), radius) | ^ Warning: 'a' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ao_util.mod' due to: ao_util.o /build/reproducible-path/cp2k-8.1/src/aobasis/ao_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod orbital_transformation_matrices.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ao_util.mod' due to: ao_util.o /build/reproducible-path/cp2k-8.1/src/aobasis/ao_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod orbital_pointers.mod orbital_transformation_matrices.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'bibliography.mod' due to: bibliography.o +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'periodic_table.mod' due to: periodic_table.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_inpp_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_inpp_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_inpp_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod cp_files.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_inpp_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_inpp_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_inpp_types.mod cp_log_handling.mod kinds.mod cp_files.mod string_utilities.mod memory_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/cp_parser_inpp_methods.F cp_parser_inpp_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_inpp_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_inpp_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:40 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_inpp_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_inpp_methods.F90 /build/reproducible-path/cp2k-8.1/src/input/cp_parser_inpp_methods.F:237:53: 237 | filename = "xc_section"//'/'//filename @@ -3167,16 +3195,16 @@ 605 | newline = input_line(1:pos1 - 3)//var_value//input_line(pos2 + 2:) | ^ Warning: '.var_value' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_inpp_methods.mod' due to: cp_parser_inpp_methods.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_inpp_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_inpp_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod cp_files.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_inpp_methods.mod' due to: cp_parser_inpp_methods.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_inpp_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_inpp_types.mod cp_log_handling.mod kinds.mod cp_files.mod string_utilities.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_ilist_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_ilist_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_ilist_types.mod base_hooks.mod cp_log_handling.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_ilist_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_ilist_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_ilist_types.mod cp_log_handling.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/cp_parser_ilist_methods.F cp_parser_ilist_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_ilist_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_ilist_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_ilist_methods.mod' due to: cp_parser_ilist_methods.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_ilist_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_ilist_types.mod base_hooks.mod cp_log_handling.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_ilist_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_ilist_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_ilist_methods.mod' due to: cp_parser_ilist_methods.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_ilist_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_ilist_types.mod cp_log_handling.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_buffer_types.mod cp_parser_types.mod string_utilities.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_parser_inpp_methods.mod cp_parser_ilist_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_parser_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_parser_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_buffer_types.mod cp_parser_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_parser_inpp_methods.mod cp_parser_ilist_methods.mod string_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/cp_parser_methods.F cp_parser_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_parser_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_parser_methods.F90 /build/reproducible-path/cp2k-8.1/src/input/cp_parser_methods.F:1400:33: 1400 | object8 = object8*iz8 @@ -3187,11 +3215,13 @@ 571 | length = MIN(len_trim_inputline - parser%icol1 + 1, length) | ^ Warning: 'length' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_methods.mod' due to: cp_parser_methods.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_buffer_types.mod cp_parser_types.mod string_utilities.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_parser_inpp_methods.mod cp_parser_ilist_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_parser_methods.mod' due to: cp_parser_methods.o /build/reproducible-path/cp2k-8.1/src/input/cp_parser_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_buffer_types.mod cp_parser_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_parser_inpp_methods.mod cp_parser_ilist_methods.mod string_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'external_potential_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/external_potential_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod string_utilities.mod periodic_table.mod ao_util.mod mathlib.mod base_hooks.mod mathconstants.mod memory_utilities.mod orbital_pointers.mod bibliography.mod orbital_transformation_matrices.mod kinds.mod cp_linked_list_input.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'bibliography.mod' due to: bibliography.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'external_potential_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/external_potential_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_val_types.mod cp_parser_types.mod input_section_types.mod mathlib.mod mathconstants.mod ao_util.mod cp_linked_list_input.mod kinds.mod orbital_pointers.mod base_hooks.mod orbital_transformation_matrices.mod memory_utilities.mod string_utilities.mod periodic_table.mod cp_parser_methods.mod bibliography.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/external_potential_types.F external_potential_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:32 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/external_potential_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' external_potential_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:37:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/external_potential_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' external_potential_types.F90 /build/reproducible-path/cp2k-8.1/src/subsys/external_potential_types.F:2339:120: 2339 | WRITE (line_att, '(A)') " # Potential name: "//apname2(:strlen2)//" for symbol: "//symbol2(:strlen1) @@ -3210,32 +3240,32 @@ | ^ Warning: 'strlen2' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/subsys/external_potential_types.F:1532:120: Warning: 'strlen1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'external_potential_types.mod' due to: external_potential_types.o /build/reproducible-path/cp2k-8.1/src/subsys/external_potential_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod string_utilities.mod periodic_table.mod ao_util.mod mathlib.mod base_hooks.mod mathconstants.mod memory_utilities.mod orbital_pointers.mod bibliography.mod orbital_transformation_matrices.mod kinds.mod cp_linked_list_input.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'external_potential_types.mod' due to: external_potential_types.o /build/reproducible-path/cp2k-8.1/src/subsys/external_potential_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_val_types.mod cp_parser_types.mod input_section_types.mod mathlib.mod mathconstants.mod ao_util.mod cp_linked_list_input.mod kinds.mod orbital_pointers.mod base_hooks.mod orbital_transformation_matrices.mod memory_utilities.mod string_utilities.mod periodic_table.mod cp_parser_methods.mod bibliography.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'damping_dipole_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/damping_dipole_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/damping_dipole_types.F damping_dipole_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/damping_dipole_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' damping_dipole_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'damping_dipole_types.mod' due to: damping_dipole_types.o /build/reproducible-path/cp2k-8.1/src/subsys/damping_dipole_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atomic_kind_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/atomic_kind_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod damping_dipole_types.mod external_potential_types.mod periodic_table.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atomic_kind_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/atomic_kind_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod external_potential_types.mod damping_dipole_types.mod kinds.mod periodic_table.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/atomic_kind_types.F atomic_kind_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/atomic_kind_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atomic_kind_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atomic_kind_types.mod' due to: atomic_kind_types.o /build/reproducible-path/cp2k-8.1/src/subsys/atomic_kind_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod damping_dipole_types.mod external_potential_types.mod periodic_table.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/atomic_kind_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atomic_kind_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atomic_kind_types.mod' due to: atomic_kind_types.o /build/reproducible-path/cp2k-8.1/src/subsys/atomic_kind_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod external_potential_types.mod damping_dipole_types.mod kinds.mod periodic_table.mod base_hooks.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'particle_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/particle_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod message_passing.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/particle_types.F particle_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/particle_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' particle_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/particle_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' particle_types.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'particle_types.mod' due to: particle_types.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'particle_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/particle_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/subsys/subsys_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'particle_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/particle_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/subsys/subsys_list.fypp particle_types.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/particle_list_types.F particle_list_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/particle_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' particle_list_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'multipole_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/multipole_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod input_section_types.mod external_potential_types.mod particle_types.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/particle_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' particle_list_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'multipole_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/multipole_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 external_potential_types.mod particle_types.mod input_section_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/multipole_types.F multipole_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/multipole_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' multipole_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_field_kind_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/force_field_kind_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/force_field_kind_types.F force_field_kind_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/force_field_kind_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_field_kind_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_field_kind_types.mod' due to: force_field_kind_types.o /build/reproducible-path/cp2k-8.1/src/subsys/force_field_kind_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'colvar_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/colvar_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod input_section_types.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/multipole_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' multipole_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'colvar_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/colvar_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod particle_types.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/colvar_types.F colvar_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/colvar_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' colvar_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/colvar_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' colvar_types.F90 /build/reproducible-path/cp2k-8.1/src/subsys/colvar_types.F:1036:82: 1036 | INTEGER, DIMENSION(:), POINTER :: i_hydrogens, i_oxygens @@ -3299,26 +3329,31 @@ 1104 | INTEGER :: i, idum, ii, n_hydrogens, & | ^ Warning: 'n_hydrogens' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'colvar_types.mod' due to: colvar_types.o /build/reproducible-path/cp2k-8.1/src/subsys/colvar_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod input_section_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'colvar_types.mod' due to: colvar_types.o /build/reproducible-path/cp2k-8.1/src/subsys/colvar_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod particle_types.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_field_kind_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/force_field_kind_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/force_field_kind_types.F force_field_kind_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/force_field_kind_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_field_kind_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_field_kind_types.mod' due to: force_field_kind_types.o /build/reproducible-path/cp2k-8.1/src/subsys/force_field_kind_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_output_handling.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_output_handling.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod cp_iter_types.mod string_utilities.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_files.mod machine.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_output_handling.o' due to: /build/reproducible-path/cp2k-8.1/src/input/cp_output_handling.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod cp_iter_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod machine.mod string_utilities.mod memory_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/cp_output_handling.F cp_output_handling.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_output_handling.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_output_handling.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:37 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/cp_output_handling.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_output_handling.F90 /build/reproducible-path/cp2k-8.1/src/input/cp_output_handling.F:731:23: 731 | outName = outPath | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_output_handling.mod' due to: cp_output_handling.o /build/reproducible-path/cp2k-8.1/src/input/cp_output_handling.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod cp_iter_types.mod string_utilities.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_files.mod machine.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_output_handling.mod' due to: cp_output_handling.o /build/reproducible-path/cp2k-8.1/src/input/cp_output_handling.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod cp_iter_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod machine.mod string_utilities.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecule_kind_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/molecule_kind_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod atomic_kind_types.mod shell_potential_types.mod input_section_types.mod colvar_types.mod cell_types.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecule_kind_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/molecule_kind_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod shell_potential_types.mod cell_types.mod force_field_kind_types.mod colvar_types.mod atomic_kind_types.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/molecule_kind_types.F molecule_kind_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:43:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/molecule_kind_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecule_kind_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molecule_kind_types.mod' due to: molecule_kind_types.o /build/reproducible-path/cp2k-8.1/src/subsys/molecule_kind_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod atomic_kind_types.mod shell_potential_types.mod input_section_types.mod colvar_types.mod cell_types.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/molecule_kind_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecule_kind_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molecule_kind_types.mod' due to: molecule_kind_types.o /build/reproducible-path/cp2k-8.1/src/subsys/molecule_kind_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod shell_potential_types.mod cell_types.mod force_field_kind_types.mod colvar_types.mod atomic_kind_types.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecule_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/molecule_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod colvar_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecule_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/molecule_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod molecule_kind_types.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/molecule_types.F molecule_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/molecule_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecule_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/molecule_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecule_types.F90 /build/reproducible-path/cp2k-8.1/src/subsys/molecule_types.F:502:94: 502 | INTEGER :: first_atom, iatom, imol, last_atom, & @@ -3341,60 +3376,60 @@ Warning: 'first_atom' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molecule_types.mod' due to: molecule_types.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecule_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/molecule_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/subsys/subsys_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecule_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/molecule_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/subsys/subsys_list.fypp molecule_types.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/molecule_list_types.F molecule_list_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/molecule_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecule_list_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecule_kind_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/molecule_kind_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/subsys/subsys_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/molecule_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecule_list_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecule_kind_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/molecule_kind_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/subsys/subsys_list.fypp molecule_kind_types.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/molecule_kind_list_types.F molecule_kind_list_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/molecule_kind_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecule_kind_list_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molecule_kind_list_types.mod' due to: molecule_kind_list_types.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atomic_kind_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/atomic_kind_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/subsys/subsys_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/atomic_kind_list_types.F atomic_kind_list_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/atomic_kind_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atomic_kind_list_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atomic_kind_list_types.mod' due to: atomic_kind_list_types.o /build/reproducible-path/cp2k-8.1/src/subsys/atomic_kind_list_types.F /build/reproducible-path/cp2k-8.1/src/subsys/subsys_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'virial_types.mod' due to: virial_types.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atprop_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/atprop_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/molecule_kind_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecule_kind_list_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atprop_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/atprop_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/atprop_types.F atprop_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/atprop_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atprop_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atprop_types.mod' due to: atprop_types.o /build/reproducible-path/cp2k-8.1/src/subsys/atprop_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/atprop_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atprop_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atprop_types.mod' due to: atprop_types.o /build/reproducible-path/cp2k-8.1/src/subsys/atprop_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'particle_list_types.mod' due to: particle_list_types.o true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molecule_kind_list_types.mod' due to: molecule_kind_list_types.o +true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'distribution_1d_types.mod' due to: distribution_1d_types.o true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'virial_types.mod' due to: virial_types.o +true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molecule_list_types.mod' due to: molecule_list_types.o true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atomic_kind_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/atomic_kind_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/subsys/subsys_list.fypp atomic_kind_types.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/atomic_kind_list_types.F atomic_kind_list_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/atomic_kind_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atomic_kind_list_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atomic_kind_list_types.mod' due to: atomic_kind_list_types.o /build/reproducible-path/cp2k-8.1/src/subsys/atomic_kind_list_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/subsys/subsys_list.fypp atomic_kind_types.mod base_hooks.mod +true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'multipole_types.mod' due to: multipole_types.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_subsys_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/cp_subsys_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod virial_types.mod particle_types.mod molecule_kind_types.mod atprop_types.mod particle_list_types.mod distribution_1d_types.mod molecule_list_types.mod multipole_types.mod atomic_kind_types.mod cp_result_types.mod colvar_types.mod molecule_types.mod kinds.mod cp_para_env.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_subsys_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subsys/cp_subsys_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_result_types.mod particle_types.mod cell_types.mod colvar_types.mod atprop_types.mod molecule_types.mod particle_list_types.mod molecule_kind_list_types.mod atomic_kind_types.mod distribution_1d_types.mod molecule_kind_types.mod virial_types.mod molecule_list_types.mod atomic_kind_list_types.mod multipole_types.mod kinds.mod cp_para_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subsys/cp_subsys_types.F cp_subsys_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/cp_subsys_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_subsys_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subsys/cp_subsys_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/subsys/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_subsys_types.F90 /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a' due to: virial_types.o shell_potential_types.o particle_types.o particle_list_types.o multipole_types.o molecule_types.o molecule_list_types.o molecule_kind_types.o molecule_kind_list_types.o force_field_kind_types.o external_potential_types.o damping_dipole_types.o cp_subsys_types.o colvar_types.o cell_types.o atprop_types.o atomic_kind_types.o atomic_kind_list_types.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a" Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a virial_types.o shell_potential_types.o particle_types.o particle_list_types.o multipole_types.o molecule_types.o molecule_list_types.o molecule_kind_types.o molecule_kind_list_types.o force_field_kind_types.o external_potential_types.o damping_dipole_types.o cp_subsys_types.o colvar_types.o cell_types.o atprop_types.o atomic_kind_types.o atomic_kind_list_types.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_blacs_calls.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_blacs_calls.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_blacs_calls.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_blacs_calls.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_blacs_calls.F cp_blacs_calls.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_blacs_calls.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_blacs_calls.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_blacs_calls.mod' due to: cp_blacs_calls.o /build/reproducible-path/cp2k-8.1/src/fm/cp_blacs_calls.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_blacs_calls.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_blacs_calls.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_blacs_calls.mod' due to: cp_blacs_calls.o /build/reproducible-path/cp2k-8.1/src/fm/cp_blacs_calls.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_blacs_env.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_blacs_env.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_blacs_calls.mod machine.mod mathlib.mod base_hooks.mod message_passing.mod cp_array_utils.mod cp_para_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_blacs_env.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_blacs_env.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mathlib.mod message_passing.mod kinds.mod cp_array_utils.mod cp_para_env.mod cp_blacs_calls.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_blacs_env.F cp_blacs_env.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_blacs_env.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_blacs_env.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_blacs_env.mod' due to: cp_blacs_env.o /build/reproducible-path/cp2k-8.1/src/fm/cp_blacs_env.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_blacs_calls.mod machine.mod mathlib.mod base_hooks.mod message_passing.mod cp_array_utils.mod cp_para_env.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_blacs_env.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_blacs_env.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_blacs_env.mod' due to: cp_blacs_env.o /build/reproducible-path/cp2k-8.1/src/fm/cp_blacs_env.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mathlib.mod message_passing.mod kinds.mod cp_array_utils.mod cp_para_env.mod cp_blacs_calls.mod machine.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_struct.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_struct.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod machine.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_blacs_env.mod cp_para_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_struct.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_struct.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod cp_para_env.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_struct.F cp_fm_struct.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_struct.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_struct.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_struct.mod' due to: cp_fm_struct.o /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_struct.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod machine.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_blacs_env.mod cp_para_env.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_struct.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_struct.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_struct.mod' due to: cp_fm_struct.o /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_struct.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod cp_para_env.mod machine.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod cp_blacs_calls.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod cp_blacs_calls.mod cp_fm_struct.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_types.F cp_fm_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:38:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_types.F90 /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_types.F:1894:40: 1894 | SUBROUTINE cp_fm_to_fm_submat_general(source, & @@ -3415,32 +3450,32 @@ 978 | ic_max_vec(mepos) = col_indices(ic_max_local) | ^ Warning: 'ic_max_local' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_types.mod' due to: cp_fm_types.o /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod cp_blacs_calls.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_types.mod' due to: cp_fm_types.o /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod cp_blacs_calls.mod cp_fm_struct.mod base_hooks.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_linked_list_fm.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_linked_list_fm.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/common/cp_linked_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_linked_list_fm.F cp_linked_list_fm.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_linked_list_fm.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_linked_list_fm.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_linked_list_fm.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_linked_list_fm.F90 /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_vect.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_vect.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_vect.F cp_fm_vect.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_vect.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_vect.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_vect.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_vect.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_linked_list_fm.mod' due to: cp_linked_list_fm.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_pool_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_pool_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod cp_log_handling.mod cp_fm_struct.mod cp_linked_list_fm.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_pool_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_pool_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_log_handling.mod cp_linked_list_fm.mod cp_fm_struct.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_pool_types.F cp_fm_pool_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_pool_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_pool_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_pool_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_pool_types.F90 /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_pool_types.F:259:27: 259 | SUBROUTINE fm_pools_copy(source_pools, target_pools) | ^ Warning: 'fm_pools_copy' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_diag_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_diag_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod mathlib.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod cp_para_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_diag_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_diag_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod mathlib.mod message_passing.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod cp_para_env.mod cp_fm_struct.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_diag_utils.F cp_fm_diag_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_diag_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_diag_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_diag_utils.mod' due to: cp_fm_diag_utils.o /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_diag_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod mathlib.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod cp_para_env.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_diag_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_diag_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_diag_utils.mod' due to: cp_fm_diag_utils.o /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_diag_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod mathlib.mod message_passing.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod cp_para_env.mod cp_fm_struct.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_basic_linalg.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_basic_linalg.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod mathlib.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod machine.mod kinds.mod kahan_sum.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_basic_linalg.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_basic_linalg.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod mathlib.mod message_passing.mod kahan_sum.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_basic_linalg.F cp_fm_basic_linalg.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_basic_linalg.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_basic_linalg.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_basic_linalg.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_basic_linalg.F90 /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_basic_linalg.F:196:25: 196 | SUBROUTINE cp_fm_geadd(alpha, trans, matrix_a, beta, matrix_b) @@ -3471,24 +3506,24 @@ 1625 | IF (PRESENT(det_a)) det_a = determinant | ^ Warning: 'determinant' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_basic_linalg.mod' due to: cp_fm_basic_linalg.o /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_basic_linalg.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod mathlib.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod machine.mod kinds.mod kahan_sum.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_basic_linalg.mod' due to: cp_fm_basic_linalg.o /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_basic_linalg.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod mathlib.mod message_passing.mod kahan_sum.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod machine.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_elpa.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_elpa.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_fm_diag_utils.mod cp_fm_struct.mod cp_blacs_env.mod machine.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_elpa.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_elpa.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_fm_diag_utils.mod cp_blacs_env.mod cp_fm_struct.mod machine.mod cp_fm_basic_linalg.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_elpa.F cp_fm_elpa.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:19 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_elpa.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_elpa.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_elpa.mod' due to: cp_fm_elpa.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_cholesky.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_cholesky.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod cp_log_handling.mod cp_blacs_env.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_elpa.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_elpa.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_cholesky.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_cholesky.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_cholesky.F cp_fm_cholesky.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_cholesky.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_cholesky.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_cholesky.mod' due to: cp_fm_cholesky.o /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_cholesky.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod cp_log_handling.mod cp_blacs_env.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_cholesky.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_cholesky.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_cholesky.mod' due to: cp_fm_cholesky.o /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_cholesky.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_elpa.mod' due to: cp_fm_elpa.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_diag.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_diag.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod cp_blacs_calls.mod cp_fm_elpa.mod machine.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_fm_diag_utils.mod cp_fm_struct.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_para_env.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_fm_diag.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_diag.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_fm_diag_utils.mod cp_fm_cholesky.mod cp_fm_elpa.mod cp_blacs_env.mod cp_blacs_calls.mod cp_para_env.mod cp_fm_struct.mod machine.mod cp_fm_basic_linalg.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_fm_diag.F cp_fm_diag.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_diag.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_diag.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_cfm_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_cfm_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod cp_blacs_calls.mod cp_log_handling.mod mathconstants.mod message_passing.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_fm_diag.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_fm_diag.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_cfm_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_cfm_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod message_passing.mod mathconstants.mod cp_log_handling.mod kinds.mod cp_blacs_env.mod cp_blacs_calls.mod cp_fm_struct.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_cfm_types.F cp_cfm_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_cfm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_cfm_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_cfm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_cfm_types.F90 /build/reproducible-path/cp2k-8.1/src/fm/cp_cfm_types.F:824:38: 824 | SUBROUTINE cp_cfm_to_cfm_triangular(msource, mtarget, uplo) @@ -3496,9 +3531,9 @@ Warning: 'cp_cfm_to_cfm_triangular' defined but not used [-Wunused-function] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_cfm_types.mod' due to: cp_cfm_types.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_cfm_basic_linalg.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_cfm_basic_linalg.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod base_hooks.mod mathconstants.mod message_passing.mod cp_fm_struct.mod kahan_sum.mod cp_blacs_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_cfm_basic_linalg.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_cfm_basic_linalg.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod message_passing.mod kahan_sum.mod mathconstants.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_cfm_basic_linalg.F cp_cfm_basic_linalg.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_cfm_basic_linalg.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_cfm_basic_linalg.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_cfm_basic_linalg.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_cfm_basic_linalg.F90 /build/reproducible-path/cp2k-8.1/src/fm/cp_cfm_basic_linalg.F:107:37: 107 | SUBROUTINE cp_cfm_schur_product_cc(matrix_a, matrix_b, matrix_c) @@ -3509,24 +3544,24 @@ 1285 | ALLOCATE (work(lwork)) | ^ Warning: 'lwork' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_cfm_basic_linalg.mod' due to: cp_cfm_basic_linalg.o /build/reproducible-path/cp2k-8.1/src/fm/cp_cfm_basic_linalg.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod base_hooks.mod mathconstants.mod message_passing.mod cp_fm_struct.mod kahan_sum.mod cp_blacs_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_cfm_basic_linalg.mod' due to: cp_cfm_basic_linalg.o /build/reproducible-path/cp2k-8.1/src/fm/cp_cfm_basic_linalg.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod message_passing.mod kahan_sum.mod mathconstants.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_cfm_diag.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_cfm_diag.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod base_hooks.mod cp_cfm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_cfm_diag.o' due to: /build/reproducible-path/cp2k-8.1/src/fm/cp_cfm_diag.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_cfm_basic_linalg.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fm/cp_cfm_diag.F cp_cfm_diag.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_cfm_diag.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_cfm_diag.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fm/cp_cfm_diag.F\"" -I'/build/reproducible-path/cp2k-8.1/src/fm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_cfm_diag.F90 /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a' due to: cp_linked_list_fm.o cp_fm_vect.o cp_fm_types.o cp_fm_struct.o cp_fm_pool_types.o cp_fm_elpa.o cp_fm_diag_utils.o cp_fm_diag.o cp_fm_cholesky.o cp_fm_basic_linalg.o cp_cfm_types.o cp_cfm_diag.o cp_cfm_basic_linalg.o cp_blacs_env.o cp_blacs_calls.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a" Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a cp_linked_list_fm.o cp_fm_vect.o cp_fm_types.o cp_fm_struct.o cp_fm_pool_types.o cp_fm_elpa.o cp_fm_diag_utils.o cp_fm_diag.o cp_fm_cholesky.o cp_fm_basic_linalg.o cp_cfm_types.o cp_cfm_diag.o cp_cfm_basic_linalg.o cp_blacs_env.o cp_blacs_calls.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'sto_ng.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/sto_ng.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'sto_ng.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/sto_ng.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/sto_ng.F sto_ng.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/sto_ng.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' sto_ng.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/sto_ng.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' sto_ng.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'gamma.mod' due to: gamma.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_coulomb.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_coulomb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 gamma.mod base_hooks.mod mathconstants.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_coulomb.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_coulomb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod orbital_pointers.mod gamma.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_coulomb.F ai_coulomb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_coulomb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_coulomb.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_coulomb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_coulomb.F90 /build/reproducible-path/cp2k-8.1/src/aobasis/ai_coulomb.F:1565:85: 1565 | fcz*v(coset(ax, ay, az), 1, cocz, n + 1) @@ -3542,13 +3577,13 @@ 1756 | coset(0, by, bz), cocx, n + 1) | ^ Warning: 'rbp[0]' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_coulomb.mod' due to: ai_coulomb.o /build/reproducible-path/cp2k-8.1/src/aobasis/ai_coulomb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 gamma.mod base_hooks.mod mathconstants.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_coulomb.mod' due to: ai_coulomb.o /build/reproducible-path/cp2k-8.1/src/aobasis/ai_coulomb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod orbital_pointers.mod gamma.mod base_hooks.mod true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'sto_ng.mod' due to: sto_ng.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'basis_set_types.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/basis_set_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod string_utilities.mod ai_coulomb.mod base_hooks.mod mathconstants.mod util.mod memory_utilities.mod orbital_pointers.mod orbital_symbols.mod sto_ng.mod bibliography.mod orbital_transformation_matrices.mod kinds.mod cp_linked_list_input.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'basis_set_types.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/basis_set_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_val_types.mod cp_parser_types.mod input_section_types.mod util.mod mathconstants.mod cp_linked_list_input.mod ai_coulomb.mod kinds.mod orbital_pointers.mod orbital_transformation_matrices.mod base_hooks.mod memory_utilities.mod string_utilities.mod sto_ng.mod orbital_symbols.mod cp_parser_methods.mod bibliography.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/basis_set_types.F basis_set_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/basis_set_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' basis_set_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:39:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/basis_set_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' basis_set_types.F90 /build/reproducible-path/cp2k-8.1/src/aobasis/basis_set_types.F:507:37: 507 | bout%name = bout%name//bad%name @@ -3592,55 +3627,55 @@ 2412 | gto_basis_set%nset = nset | ^ Warning: 'nshell' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'basis_set_types.mod' due to: basis_set_types.o /build/reproducible-path/cp2k-8.1/src/aobasis/basis_set_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod string_utilities.mod ai_coulomb.mod base_hooks.mod mathconstants.mod util.mod memory_utilities.mod orbital_pointers.mod orbital_symbols.mod sto_ng.mod bibliography.mod orbital_transformation_matrices.mod kinds.mod cp_linked_list_input.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'basis_set_types.mod' due to: basis_set_types.o /build/reproducible-path/cp2k-8.1/src/aobasis/basis_set_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_val_types.mod cp_parser_types.mod input_section_types.mod util.mod mathconstants.mod cp_linked_list_input.mod ai_coulomb.mod kinds.mod orbital_pointers.mod orbital_transformation_matrices.mod base_hooks.mod memory_utilities.mod string_utilities.mod sto_ng.mod orbital_symbols.mod cp_parser_methods.mod bibliography.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'soft_basis_set.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/soft_basis_set.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod ao_util.mod base_hooks.mod orbital_symbols.mod orbital_pointers.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'soft_basis_set.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/soft_basis_set.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod ao_util.mod kinds.mod orbital_pointers.mod orbital_symbols.mod memory_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/soft_basis_set.F soft_basis_set.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/soft_basis_set.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' soft_basis_set.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'basis_set_container_types.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/basis_set_container_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:40:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/soft_basis_set.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' soft_basis_set.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'basis_set_container_types.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/basis_set_container_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/basis_set_container_types.F basis_set_container_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/basis_set_container_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' basis_set_container_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:40:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/basis_set_container_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' basis_set_container_types.F90 /build/reproducible-path/cp2k-8.1/src/aobasis/basis_set_container_types.F:198:38: 198 | DO i = ibas + 1, SIZE(container) | ^ Warning: 'ibas' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'aux_basis_set.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/aux_basis_set.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod lapack.mod orbital_symbols.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'aux_basis_set.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/aux_basis_set.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod lapack.mod kinds.mod orbital_pointers.mod orbital_symbols.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/aux_basis_set.F aux_basis_set.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/aux_basis_set.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' aux_basis_set.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_verfc.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_verfc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 gamma.mod base_hooks.mod mathconstants.mod orbital_pointers.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:40:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/aux_basis_set.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' aux_basis_set.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_verfc.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_verfc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod orbital_pointers.mod gamma.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_verfc.F ai_verfc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:44:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_verfc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_verfc.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_os_rr.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_os_rr.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod gamma.mod kinds.mod orbital_pointers.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:40:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_verfc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_verfc.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_os_rr.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_os_rr.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod base_hooks.mod gamma.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_os_rr.F ai_os_rr.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_os_rr.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_os_rr.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_os_rr.mod' due to: ai_os_rr.o /build/reproducible-path/cp2k-8.1/src/aobasis/ai_os_rr.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod gamma.mod kinds.mod orbital_pointers.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:40:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_os_rr.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_os_rr.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_os_rr.mod' due to: ai_os_rr.o /build/reproducible-path/cp2k-8.1/src/aobasis/ai_os_rr.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod base_hooks.mod gamma.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_spin_orbit.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_spin_orbit.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod ai_os_rr.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_spin_orbit.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_spin_orbit.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod orbital_pointers.mod ai_os_rr.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_spin_orbit.F ai_spin_orbit.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_spin_orbit.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_spin_orbit.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_overlap_debug.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap_debug.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:40:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_spin_orbit.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_spin_orbit.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_overlap_debug.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap_debug.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap_debug.F ai_overlap_debug.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap_debug.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap_debug.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_overlap_debug.mod' due to: ai_overlap_debug.o /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap_debug.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:40:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap_debug.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap_debug.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_overlap_debug.mod' due to: ai_overlap_debug.o /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap_debug.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_oneelectron.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_oneelectron.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_oneelectron.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_oneelectron.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_oneelectron.F ai_oneelectron.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_oneelectron.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_oneelectron.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_oneelectron.mod' due to: ai_oneelectron.o /build/reproducible-path/cp2k-8.1/src/aobasis/ai_oneelectron.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:40:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_oneelectron.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_oneelectron.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_oneelectron.mod' due to: ai_oneelectron.o /build/reproducible-path/cp2k-8.1/src/aobasis/ai_oneelectron.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_overlap_ppl.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap_ppl.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ai_overlap_debug.mod base_hooks.mod mathconstants.mod ai_oneelectron.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_overlap_ppl.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap_ppl.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod orbital_pointers.mod ai_overlap_debug.mod ai_oneelectron.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap_ppl.F ai_overlap_ppl.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap_ppl.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap_ppl.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_overlap_aabb.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap_aabb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod orbital_pointers.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:40:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap_ppl.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap_ppl.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_overlap_aabb.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap_aabb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap_aabb.F ai_overlap_aabb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:10 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap_aabb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap_aabb.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_overlap3_debug.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap3_debug.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:40:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap_aabb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap_aabb.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_overlap3_debug.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap3_debug.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap3_debug.F ai_overlap3_debug.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap3_debug.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap3_debug.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_overlap3.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap3.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod orbital_pointers.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:40:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap3_debug.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap3_debug.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_overlap3.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap3.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap3.F ai_overlap3.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap3.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap3.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:40:56 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap3.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap3.F90 /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap3.F:135:68: 135 | REAL(KIND=dp), DIMENSION(:, :, :, :), POINTER :: sda, sdc @@ -3680,9 +3715,9 @@ | ^ note: 'sda.dim[3].stride' was declared here /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap3.F:135:63: Warning: 'sda.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_overlap.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod ai_os_rr.mod orbital_transformation_matrices.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_overlap.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod orbital_pointers.mod orbital_transformation_matrices.mod ai_os_rr.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap.F ai_overlap.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:41:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_overlap.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_overlap.F90 /build/reproducible-path/cp2k-8.1/src/aobasis/ai_overlap.F:1364:26: 1364 | SUBROUTINE overlap_aaab(la1_max, la1_min, npgfa1, rpgfa1, zeta1, & @@ -3700,15 +3735,15 @@ Warning: 'overlap_abbb' defined but not used [-Wunused-function] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 't_c_g0.mod' due to: t_c_g0.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_operators_r12.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_operators_r12.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 t_c_g0.mod gamma.mod base_hooks.mod mathconstants.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_operators_r12.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_operators_r12.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod orbital_pointers.mod t_c_g0.mod gamma.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_operators_r12.F ai_operators_r12.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_operators_r12.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_operators_r12.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_operator_ra2m.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_operator_ra2m.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod ai_os_rr.mod orbital_pointers.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:41:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_operators_r12.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_operators_r12.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_operator_ra2m.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_operator_ra2m.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod orbital_pointers.mod ai_os_rr.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_operator_ra2m.F ai_operator_ra2m.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_operator_ra2m.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_operator_ra2m.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_onecenter.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_onecenter.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:41:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_operator_ra2m.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_operator_ra2m.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_onecenter.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_onecenter.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_onecenter.F ai_onecenter.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_onecenter.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_onecenter.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:41:32 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_onecenter.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_onecenter.F90 /build/reproducible-path/cp2k-8.1/src/aobasis/ai_onecenter.F:798:22: 798 | SUBROUTINE sto_conf(gmat, rc, k, na, pa, nb, pb) @@ -3754,25 +3789,25 @@ 1156 | SUBROUTINE num_conf(gmat, rc, k, ra, rb, r, wr) | ^ Warning: 'num_conf' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_overlap.mod' due to: ai_overlap.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_derivatives.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_derivatives.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_derivatives.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_derivatives.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_derivatives.F ai_derivatives.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_derivatives.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_derivatives.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_derivatives.mod' due to: ai_derivatives.o /build/reproducible-path/cp2k-8.1/src/aobasis/ai_derivatives.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:41:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_derivatives.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_derivatives.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_derivatives.mod' due to: ai_derivatives.o /build/reproducible-path/cp2k-8.1/src/aobasis/ai_derivatives.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_overlap.mod' due to: ai_overlap.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_moments.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_moments.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ai_overlap.mod base_hooks.mod mathconstants.mod orbital_pointers.mod kinds.mod ai_derivatives.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_moments.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_moments.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod orbital_pointers.mod ai_derivatives.mod ai_overlap.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_moments.F ai_moments.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_moments.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_moments.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:41:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_moments.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_moments.F90 /build/reproducible-path/cp2k-8.1/src/aobasis/ai_moments.F:883:46: 883 | s(1, 1, l) = rpc(i)*s(1, 1, l1) | ^ Warning: 'l1' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/aobasis/ai_moments.F:883:46: Warning: 'i' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_kinetic.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_kinetic.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod ai_os_rr.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_kinetic.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_kinetic.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod orbital_pointers.mod ai_os_rr.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_kinetic.F ai_kinetic.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_kinetic.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_kinetic.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_kinetic.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_kinetic.F90 /build/reproducible-path/cp2k-8.1/src/aobasis/ai_kinetic.F:73:77: 73 | ib, idx, idy, idz, ipgf, jpgf, la, lb, & @@ -3788,66 +3823,66 @@ 73 | ib, idx, idy, idz, ipgf, jpgf, la, lb, & | ^ Warning: 'idx' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_fermi_contact.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_fermi_contact.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod orbital_pointers.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_fermi_contact.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_fermi_contact.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_fermi_contact.F ai_fermi_contact.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_fermi_contact.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_fermi_contact.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_eri_debug.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_eri_debug.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod gamma.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_fermi_contact.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_fermi_contact.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_eri_debug.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_eri_debug.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod base_hooks.mod gamma.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_eri_debug.F ai_eri_debug.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_eri_debug.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_eri_debug.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_eri_debug.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_eri_debug.F90 /build/reproducible-path/cp2k-8.1/src/aobasis/ai_eri_debug.F:56:21: 56 | SUBROUTINE init_os(ya, yb, yc, yd, rA, rB, rC, rD) | ^ Warning: 'init_os' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_elec_field.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_elec_field.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod ai_os_rr.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_elec_field.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_elec_field.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod orbital_pointers.mod ai_os_rr.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_elec_field.F ai_elec_field.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_elec_field.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_elec_field.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_coulomb_test.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_coulomb_test.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ai_coulomb.mod base_hooks.mod machine.mod orbital_pointers.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_elec_field.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_elec_field.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_coulomb_test.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_coulomb_test.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod orbital_pointers.mod ai_coulomb.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_coulomb_test.F ai_coulomb_test.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_coulomb_test.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_coulomb_test.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_contraction_sphi.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_contraction_sphi.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_coulomb_test.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_coulomb_test.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_contraction_sphi.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_contraction_sphi.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_contraction_sphi.F ai_contraction_sphi.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_contraction_sphi.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_contraction_sphi.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_contraction.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_contraction.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_contraction_sphi.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_contraction_sphi.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_contraction.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_contraction.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_contraction.F ai_contraction.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_contraction.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_contraction.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_contraction.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_contraction.F90 /build/reproducible-path/cp2k-8.1/src/aobasis/ai_contraction.F:84:88: 84 | INTEGER :: lda, ldb, ldq, lds, ldw, mal, mbl, nal, & | ^ Warning: 'mal' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_angmom.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_angmom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod orbital_pointers.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ai_angmom.o' due to: /build/reproducible-path/cp2k-8.1/src/aobasis/ai_angmom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/aobasis/ai_angmom.F ai_angmom.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_angmom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_angmom.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:24 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"aobasis/ai_angmom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/aobasis/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ai_angmom.F90 /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a' due to: sto_ng.o soft_basis_set.o orbital_transformation_matrices.o orbital_symbols.o orbital_pointers.o basis_set_types.o basis_set_container_types.o aux_basis_set.o ao_util.o ai_verfc.o ai_spin_orbit.o ai_overlap_ppl.o ai_overlap_debug.o ai_overlap_aabb.o ai_overlap3_debug.o ai_overlap3.o ai_overlap.o ai_os_rr.o ai_operators_r12.o ai_operator_ra2m.o ai_oneelectron.o ai_onecenter.o ai_moments.o ai_kinetic.o ai_fermi_contact.o ai_eri_debug.o ai_elec_field.o ai_derivatives.o ai_coulomb_test.o ai_coulomb.o ai_contraction_sphi.o ai_contraction.o ai_angmom.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a" Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a sto_ng.o soft_basis_set.o orbital_transformation_matrices.o orbital_symbols.o orbital_pointers.o basis_set_types.o basis_set_container_types.o aux_basis_set.o ao_util.o ai_verfc.o ai_spin_orbit.o ai_overlap_ppl.o ai_overlap_debug.o ai_overlap_aabb.o ai_overlap3_debug.o ai_overlap3.o ai_overlap.o ai_os_rr.o ai_operators_r12.o ai_operator_ra2m.o ai_oneelectron.o ai_onecenter.o ai_moments.o ai_kinetic.o ai_fermi_contact.o ai_eri_debug.o ai_elec_field.o ai_derivatives.o ai_coulomb_test.o ai_coulomb.o ai_contraction_sphi.o ai_contraction.o ai_angmom.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_parsing.o' due to: /build/reproducible-path/cp2k-8.1/src/input/input_parsing.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_enumeration_types.mod input_section_types.mod cp_parser_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod kinds.mod cp_linked_list_input.mod cp_units.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_parsing.o' due to: /build/reproducible-path/cp2k-8.1/src/input/input_parsing.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cp_parser_types.mod input_enumeration_types.mod input_section_types.mod input_keyword_types.mod cp_log_handling.mod cp_linked_list_input.mod kinds.mod base_hooks.mod string_utilities.mod cp_parser_methods.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input/input_parsing.F input_parsing.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_parsing.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_parsing.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input/input_parsing.F\"" -I'/build/reproducible-path/cp2k-8.1/src/input/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_parsing.F90 /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a' due to: input_val_types.o input_section_types.o input_parsing.o input_keyword_types.o input_enumeration_types.o cp_parser_types.o cp_parser_status_types.o cp_parser_methods.o cp_parser_inpp_types.o cp_parser_inpp_methods.o cp_parser_ilist_types.o cp_parser_ilist_methods.o cp_parser_buffer_types.o cp_output_handling.o cp_linked_list_input.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a" Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a input_val_types.o input_section_types.o input_parsing.o input_keyword_types.o input_enumeration_types.o cp_parser_types.o cp_parser_status_types.o cp_parser_methods.o cp_parser_inpp_types.o cp_parser_inpp_methods.o cp_parser_ilist_types.o cp_parser_ilist_methods.o cp_parser_buffer_types.o cp_output_handling.o cp_linked_list_input.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_linked_list_pw.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/cp_linked_list_pw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/common/cp_linked_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod base_hooks.mod cp_array_utils.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_linked_list_pw.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/cp_linked_list_pw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/common/cp_linked_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod realspace_grid_types.mod cp_array_utils.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/cp_linked_list_pw.F cp_linked_list_pw.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/cp_linked_list_pw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_linked_list_pw.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_linked_list_pw.mod' due to: cp_linked_list_pw.o /build/reproducible-path/cp2k-8.1/src/pw/cp_linked_list_pw.F /build/reproducible-path/cp2k-8.1/src/common/cp_linked_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod base_hooks.mod cp_array_utils.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/cp_linked_list_pw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_linked_list_pw.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_linked_list_pw.mod' due to: cp_linked_list_pw.o /build/reproducible-path/cp2k-8.1/src/pw/cp_linked_list_pw.F /build/reproducible-path/cp2k-8.1/src/common/cp_linked_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod realspace_grid_types.mod cp_array_utils.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_pool_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_pool_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_grid_types.mod pw_methods.mod cp_log_handling.mod timings.mod base_hooks.mod cp_linked_list_pw.mod pw_grids.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_pool_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_pool_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod cp_log_handling.mod kinds.mod timings.mod pw_grids.mod pw_methods.mod cp_linked_list_pw.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/pw_pool_types.F pw_pool_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_pool_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_pool_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_pool_types.mod' due to: pw_pool_types.o /build/reproducible-path/cp2k-8.1/src/pw/pw_pool_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_grid_types.mod pw_methods.mod cp_log_handling.mod timings.mod base_hooks.mod cp_linked_list_pw.mod pw_grids.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_pool_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_pool_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_pool_types.mod' due to: pw_pool_types.o /build/reproducible-path/cp2k-8.1/src/pw/pw_pool_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod cp_log_handling.mod kinds.mod timings.mod pw_grids.mod pw_methods.mod cp_linked_list_pw.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rs_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/rs_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod pw_pool_types.mod pw_grid_types.mod pw_methods.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rs_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/rs_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod pw_types.mod realspace_grid_types.mod kinds.mod pw_methods.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/rs_methods.F rs_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/rs_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rs_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'realspace_grid_cube.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/realspace_grid_cube.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_grid_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_files.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/rs_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rs_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'realspace_grid_cube.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/realspace_grid_cube.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_files.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/realspace_grid_cube.F realspace_grid_cube.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/realspace_grid_cube.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' realspace_grid_cube.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/realspace_grid_cube.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' realspace_grid_cube.F90 /build/reproducible-path/cp2k-8.1/src/pw/realspace_grid_cube.F:771:65: 771 | IF (MODULO(counter, num_entries_line) == 0 .OR. k == last_z) & @@ -3858,9 +3893,9 @@ 642 | INTEGER :: counter, gid, i, islice, j, k, last_z, & | ^ note: 'last_z' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_spline_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_spline_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_pool_types.mod pw_grid_types.mod pw_methods.mod cp_log_handling.mod mathconstants.mod message_passing.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_spline_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_spline_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod pw_types.mod message_passing.mod mathconstants.mod cp_log_handling.mod kinds.mod pw_methods.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/pw_spline_utils.F pw_spline_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:45:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_spline_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_spline_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:42:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_spline_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_spline_utils.F90 /build/reproducible-path/cp2k-8.1/src/pw/pw_spline_utils.F:2620:38: 2620 | SUBROUTINE pw_spline_precond_retain(preconditioner) @@ -3871,19 +3906,19 @@ 953 | weights(i, j, k) = REAL(idirVal, dp)*coeffs(ABS(i) + ABS(j) + ABS(k)) | ^ Warning: 'idirval' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dielectric_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dielectric_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_pool_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/dielectric_types.F dielectric_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dielectric_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dielectric_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dielectric_types.mod' due to: dielectric_types.o /build/reproducible-path/cp2k-8.1/src/pw/dielectric_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_pool_types.mod base_hooks.mod kinds.mod -true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dirichlet_bc_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dirichlet_bc_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_pool_types.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/dirichlet_bc_types.F dirichlet_bc_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dirichlet_bc_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dirichlet_bc_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:43:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dirichlet_bc_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dirichlet_bc_types.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dirichlet_bc_types.mod' due to: dirichlet_bc_types.o /build/reproducible-path/cp2k-8.1/src/pw/dirichlet_bc_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_pool_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dct.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dct.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_grid_types.mod base_hooks.mod message_passing.mod fast.mod pw_grids.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dielectric_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dielectric_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_pool_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/dielectric_types.F dielectric_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:43:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dielectric_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dielectric_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dielectric_types.mod' due to: dielectric_types.o /build/reproducible-path/cp2k-8.1/src/pw/dielectric_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_pool_types.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dct.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dct.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod message_passing.mod kinds.mod pw_grids.mod fast.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/dct.F dct.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dct.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dct.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:43:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dct.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dct.F90 /build/reproducible-path/cp2k-8.1/src/pw/dct.F:459:59: 459 | ALLOCATE (srcs_expand_all(maxn_sendrecv, group_size)) @@ -3944,28 +3979,28 @@ 113 | ALLOCATE (dct_env%flipg_stat(maxn_sendrecv)) | ^ Warning: 'maxn_sendrecv' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dct.mod' due to: dct.o /build/reproducible-path/cp2k-8.1/src/pw/dct.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_grid_types.mod base_hooks.mod message_passing.mod fast.mod pw_grids.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dct.mod' due to: dct.o /build/reproducible-path/cp2k-8.1/src/pw/dct.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod message_passing.mod kinds.mod pw_grids.mod fast.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_implicit_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_implicit_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dielectric_types.mod dirichlet_bc_types.mod pw_types.mod pw_pool_types.mod base_hooks.mod dct.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_implicit_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_implicit_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_types.mod dirichlet_bc_types.mod dielectric_types.mod kinds.mod dct.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_implicit_types.F ps_implicit_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_implicit_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_implicit_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_implicit_types.mod' due to: ps_implicit_types.o /build/reproducible-path/cp2k-8.1/src/pw/ps_implicit_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dielectric_types.mod dirichlet_bc_types.mod pw_types.mod pw_pool_types.mod base_hooks.mod dct.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:43:37 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_implicit_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_implicit_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_implicit_types.mod' due to: ps_implicit_types.o /build/reproducible-path/cp2k-8.1/src/pw/ps_implicit_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_types.mod dirichlet_bc_types.mod dielectric_types.mod kinds.mod dct.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_types.F ps_wavelet_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_types.mod' due to: ps_wavelet_types.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:43:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_types.mod' due to: ps_wavelet_types.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mt_util.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/mt_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_pool_types.mod pw_grid_types.mod pw_methods.mod base_hooks.mod mathconstants.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mt_util.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/mt_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod pw_types.mod mathconstants.mod kinds.mod pw_methods.mod bibliography.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/mt_util.F mt_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/mt_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mt_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mt_util.mod' due to: mt_util.o /build/reproducible-path/cp2k-8.1/src/pw/mt_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_pool_types.mod pw_grid_types.mod pw_methods.mod base_hooks.mod mathconstants.mod bibliography.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:43:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/mt_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mt_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mt_util.mod' due to: mt_util.o /build/reproducible-path/cp2k-8.1/src/pw/mt_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod pw_types.mod mathconstants.mod kinds.mod pw_methods.mod bibliography.mod base_hooks.mod true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'bessel_lib.mod' due to: bessel_lib.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_poisson_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_poisson_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dielectric_types.mod dirichlet_bc_types.mod ps_implicit_types.mod ps_wavelet_types.mod realspace_grid_types.mod pw_types.mod pw_pool_types.mod pw_grid_types.mod mt_util.mod mathconstants.mod base_hooks.mod pw_grids.mod bessel_lib.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_poisson_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_poisson_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ps_implicit_types.mod ps_wavelet_types.mod pw_grid_types.mod pw_pool_types.mod pw_types.mod dirichlet_bc_types.mod dielectric_types.mod realspace_grid_types.mod mathconstants.mod kinds.mod mt_util.mod pw_grids.mod bessel_lib.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/pw_poisson_types.F pw_poisson_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:10 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_poisson_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_poisson_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:43:40 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_poisson_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_poisson_types.F90 /build/reproducible-path/cp2k-8.1/src/pw/pw_poisson_types.F:445:29: 445 | SUBROUTINE pw_green_retain(gftype) @@ -3975,74 +4010,9 @@ true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rs_methods.mod' due to: rs_methods.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dielectric_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dielectric_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dielectric_types.mod realspace_grid_types.mod pw_types.mod pw_pool_types.mod pw_grid_types.mod pw_methods.mod mathconstants.mod base_hooks.mod dct.mod rs_methods.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/dielectric_methods.F dielectric_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dielectric_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dielectric_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dielectric_methods.mod' due to: dielectric_methods.o /build/reproducible-path/cp2k-8.1/src/pw/dielectric_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dielectric_types.mod realspace_grid_types.mod pw_types.mod pw_pool_types.mod pw_grid_types.mod pw_methods.mod mathconstants.mod base_hooks.mod dct.mod rs_methods.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_fft3d.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_fft3d.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_fft3d.F ps_wavelet_fft3d.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_fft3d.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_fft3d.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_fft3d.mod' due to: ps_wavelet_fft3d.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_fft3d.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_base.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_base.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod ps_wavelet_fft3d.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_base.F ps_wavelet_base.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_base.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_base.F90 -/build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_base.F:2103:31: - - 2103 | SUBROUTINE F_unfill_downcorn(md1, md3, lot, nfft, n3, zw, zf, scal, ehartreetmp) - | ^ -Warning: 'f_unfill_downcorn' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_base.mod' due to: ps_wavelet_base.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_base.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod ps_wavelet_fft3d.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_util.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod base_hooks.mod mathconstants.mod ps_wavelet_base.mod ps_wavelet_fft3d.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_util.F ps_wavelet_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_util.F90 -/build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_util.F:155:58: - - 155 | DO i2 = istart + 1, MIN(nlim, istart + md2/nproc) - | ^ -Warning: 'nlim' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_util.mod' due to: ps_wavelet_util.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod base_hooks.mod mathconstants.mod ps_wavelet_base.mod ps_wavelet_fft3d.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lazy.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/lazy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/lazy.F lazy.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/lazy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lazy.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lazy.mod' due to: lazy.o /build/reproducible-path/cp2k-8.1/src/pw/lazy.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_scaling_function.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lazy.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F ps_wavelet_scaling_function.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_scaling_function.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_scaling_function.F90 -/build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F:92:30: - - 92 | SUBROUTINE wavelet_function(itype, nd, a, x) - | ^ -Warning: 'wavelet_function' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F:196:23: - - 196 | SUBROUTINE for_trans(nd, nt, x, y, m, cgt, cht) - | ^ -Warning: 'for_trans' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F:296:19: - - 296 | SUBROUTINE ftest(m, ch, cg, cgt, cht) - | ^ -Warning: 'ftest' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_scaling_function.mod' due to: ps_wavelet_scaling_function.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lazy.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_kernel.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_kernel.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ps_wavelet_util.mod base_hooks.mod message_passing.mod ps_wavelet_base.mod ps_wavelet_scaling_function.mod ps_wavelet_fft3d.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_kernel.F ps_wavelet_kernel.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_kernel.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_kernel.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_kernel.mod' due to: ps_wavelet_kernel.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_kernel.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ps_wavelet_util.mod base_hooks.mod message_passing.mod ps_wavelet_base.mod ps_wavelet_scaling_function.mod ps_wavelet_fft3d.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ps_wavelet_types.mod pw_poisson_types.mod pw_types.mod pw_grid_types.mod ps_wavelet_util.mod base_hooks.mod message_passing.mod ps_wavelet_kernel.mod bibliography.mod util.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_methods.F ps_wavelet_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:32 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_methods.mod' due to: ps_wavelet_methods.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ps_wavelet_types.mod pw_poisson_types.mod pw_types.mod pw_grid_types.mod ps_wavelet_util.mod base_hooks.mod message_passing.mod ps_wavelet_kernel.mod bibliography.mod util.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dirichlet_bc_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dirichlet_bc_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dirichlet_bc_types.mod ps_implicit_types.mod pw_poisson_types.mod pw_types.mod pw_pool_types.mod pw_grid_types.mod mathlib.mod cp_log_handling.mod mathconstants.mod message_passing.mod pw_methods.mod base_hooks.mod rs_methods.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dirichlet_bc_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dirichlet_bc_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod ps_implicit_types.mod pw_grid_types.mod pw_pool_types.mod pw_types.mod dirichlet_bc_types.mod mathlib.mod message_passing.mod mathconstants.mod cp_log_handling.mod rs_methods.mod kinds.mod pw_methods.mod physcon.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/dirichlet_bc_methods.F dirichlet_bc_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dirichlet_bc_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dirichlet_bc_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:43:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dirichlet_bc_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dirichlet_bc_methods.F90 /build/reproducible-path/cp2k-8.1/src/pw/dirichlet_bc_methods.F:899:13: 899 | IF (h .GT. MINVAL((/Lx, Lz/))) THEN @@ -4053,11 +4023,16 @@ 814 | REAL(dp) :: cntrlaxis_lb, cntrlaxis_ub, h, Lx, Ly, & | ^ note: 'h' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dirichlet_bc_methods.mod' due to: dirichlet_bc_methods.o /build/reproducible-path/cp2k-8.1/src/pw/dirichlet_bc_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dirichlet_bc_types.mod ps_implicit_types.mod pw_poisson_types.mod pw_types.mod pw_pool_types.mod pw_grid_types.mod mathlib.mod cp_log_handling.mod mathconstants.mod message_passing.mod pw_methods.mod base_hooks.mod rs_methods.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dirichlet_bc_methods.mod' due to: dirichlet_bc_methods.o /build/reproducible-path/cp2k-8.1/src/pw/dirichlet_bc_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod ps_implicit_types.mod pw_grid_types.mod pw_pool_types.mod pw_types.mod dirichlet_bc_types.mod mathlib.mod message_passing.mod mathconstants.mod cp_log_handling.mod rs_methods.mod kinds.mod pw_methods.mod physcon.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dielectric_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dielectric_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod pw_types.mod dielectric_types.mod realspace_grid_types.mod mathconstants.mod rs_methods.mod kinds.mod pw_methods.mod dct.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/dielectric_methods.F dielectric_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:44:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dielectric_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dielectric_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dielectric_methods.mod' due to: dielectric_methods.o /build/reproducible-path/cp2k-8.1/src/pw/dielectric_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod pw_types.mod dielectric_types.mod realspace_grid_types.mod mathconstants.mod rs_methods.mod kinds.mod pw_methods.mod dct.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_implicit_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_implicit_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dielectric_types.mod dirichlet_bc_types.mod ps_implicit_types.mod pw_poisson_types.mod pw_types.mod pw_pool_types.mod pw_grid_types.mod dielectric_methods.mod cp_log_handling.mod mathconstants.mod message_passing.mod dct.mod pw_methods.mod base_hooks.mod dirichlet_bc_methods.mod bibliography.mod kinds.mod kahan_sum.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_implicit_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_implicit_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod ps_implicit_types.mod pw_grid_types.mod pw_pool_types.mod pw_types.mod dirichlet_bc_types.mod dielectric_types.mod message_passing.mod kahan_sum.mod cp_log_handling.mod mathconstants.mod kinds.mod pw_methods.mod base_hooks.mod dct.mod dirichlet_bc_methods.mod dielectric_methods.mod bibliography.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_implicit_methods.F ps_implicit_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_implicit_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_implicit_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:44:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_implicit_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_implicit_methods.F90 /build/reproducible-path/cp2k-8.1/src/pw/ps_implicit_methods.F:1199:87: 1199 | CALL pw_scale(pw_in, 1.0_dp/(vol_scfac*tile_volume)) ! normalize tile_pw @@ -4073,24 +4048,84 @@ 433 | ps_implicit_env%ehartree = ehartree/vol_scfac | ^ Warning: 'vol_scfac' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_implicit_methods.mod' due to: ps_implicit_methods.o /build/reproducible-path/cp2k-8.1/src/pw/ps_implicit_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dielectric_types.mod dirichlet_bc_types.mod ps_implicit_types.mod pw_poisson_types.mod pw_types.mod pw_pool_types.mod pw_grid_types.mod dielectric_methods.mod cp_log_handling.mod mathconstants.mod message_passing.mod dct.mod pw_methods.mod base_hooks.mod dirichlet_bc_methods.mod bibliography.mod kinds.mod kahan_sum.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_implicit_methods.mod' due to: ps_implicit_methods.o /build/reproducible-path/cp2k-8.1/src/pw/ps_implicit_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod ps_implicit_types.mod pw_grid_types.mod pw_pool_types.mod pw_types.mod dirichlet_bc_types.mod dielectric_types.mod message_passing.mod kahan_sum.mod cp_log_handling.mod mathconstants.mod kinds.mod pw_methods.mod base_hooks.mod dct.mod dirichlet_bc_methods.mod dielectric_methods.mod bibliography.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lazy.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/lazy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/lazy.F lazy.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:44:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/lazy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lazy.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lazy.mod' due to: lazy.o /build/reproducible-path/cp2k-8.1/src/pw/lazy.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_scaling_function.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lazy.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F ps_wavelet_scaling_function.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:44:26 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_scaling_function.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_scaling_function.F90 +/build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F:92:30: + + 92 | SUBROUTINE wavelet_function(itype, nd, a, x) + | ^ +Warning: 'wavelet_function' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F:196:23: + + 196 | SUBROUTINE for_trans(nd, nt, x, y, m, cgt, cht) + | ^ +Warning: 'for_trans' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F:296:19: + + 296 | SUBROUTINE ftest(m, ch, cg, cgt, cht) + | ^ +Warning: 'ftest' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_scaling_function.mod' due to: ps_wavelet_scaling_function.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_scaling_function.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lazy.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_fft3d.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_fft3d.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_fft3d.F ps_wavelet_fft3d.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:44:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_fft3d.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_fft3d.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_fft3d.mod' due to: ps_wavelet_fft3d.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_fft3d.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_base.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_base.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod base_hooks.mod ps_wavelet_fft3d.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_base.F ps_wavelet_base.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:44:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_base.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_base.F90 +/build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_base.F:2103:31: + + 2103 | SUBROUTINE F_unfill_downcorn(md1, md3, lot, nfft, n3, zw, zf, scal, ehartreetmp) + | ^ +Warning: 'f_unfill_downcorn' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_base.mod' due to: ps_wavelet_base.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_base.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod base_hooks.mod ps_wavelet_fft3d.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_util.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod mathconstants.mod kinds.mod ps_wavelet_fft3d.mod ps_wavelet_base.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_util.F ps_wavelet_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:44:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_util.F90 +/build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_util.F:155:58: + + 155 | DO i2 = istart + 1, MIN(nlim, istart + md2/nproc) + | ^ +Warning: 'nlim' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_util.mod' due to: ps_wavelet_util.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod mathconstants.mod kinds.mod ps_wavelet_fft3d.mod ps_wavelet_base.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_kernel.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_kernel.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod kinds.mod ps_wavelet_scaling_function.mod ps_wavelet_fft3d.mod ps_wavelet_util.mod ps_wavelet_base.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_kernel.F ps_wavelet_kernel.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:44:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_kernel.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_kernel.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_kernel.mod' due to: ps_wavelet_kernel.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_kernel.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod kinds.mod ps_wavelet_scaling_function.mod ps_wavelet_fft3d.mod ps_wavelet_util.mod ps_wavelet_base.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_poisson_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_poisson_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ps_implicit_types.mod ps_wavelet_types.mod pw_poisson_types.mod pw_types.mod pw_pool_types.mod pw_grid_types.mod mt_util.mod dielectric_methods.mod cp_log_handling.mod mathconstants.mod pw_methods.mod base_hooks.mod ps_wavelet_methods.mod pw_grids.mod ps_implicit_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ps_wavelet_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod ps_wavelet_types.mod pw_grid_types.mod pw_types.mod message_passing.mod util.mod kinds.mod ps_wavelet_kernel.mod ps_wavelet_util.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_methods.F ps_wavelet_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:45:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/ps_wavelet_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ps_wavelet_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ps_wavelet_methods.mod' due to: ps_wavelet_methods.o /build/reproducible-path/cp2k-8.1/src/pw/ps_wavelet_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod ps_wavelet_types.mod pw_grid_types.mod pw_types.mod message_passing.mod util.mod kinds.mod ps_wavelet_kernel.mod ps_wavelet_util.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_poisson_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/pw_poisson_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod ps_implicit_types.mod ps_wavelet_types.mod pw_grid_types.mod pw_pool_types.mod pw_types.mod ps_implicit_methods.mod mathconstants.mod cp_log_handling.mod kinds.mod mt_util.mod pw_grids.mod pw_methods.mod ps_wavelet_methods.mod dielectric_methods.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/pw_poisson_methods.F pw_poisson_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_poisson_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_poisson_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:45:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/pw_poisson_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_poisson_methods.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'structure_factors.mod' due to: structure_factors.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dgs.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dgs.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod pw_grid_types.mod mathlib.mod base_hooks.mod fast.mod pw_grid_info.mod structure_factors.mod pw_grids.mod kinds.mod fft_tools.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dgs.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dgs.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_types.mod realspace_grid_types.mod mathlib.mod structure_factors.mod kinds.mod pw_grids.mod fast.mod fft_tools.mod pw_grid_info.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/dgs.F dgs.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dgs.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dgs.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dg_rho0_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dg_rho0_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod pw_types.mod pw_grid_types.mod pw_methods.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:45:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dgs.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dgs.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dg_rho0_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dg_rho0_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod pw_grid_types.mod pw_types.mod kinds.mod pw_methods.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/dg_rho0_types.F dg_rho0_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dg_rho0_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dg_rho0_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dg_rho0_types.mod' due to: dg_rho0_types.o /build/reproducible-path/cp2k-8.1/src/pw/dg_rho0_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod pw_types.mod pw_grid_types.mod pw_methods.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:45:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dg_rho0_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dg_rho0_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dg_rho0_types.mod' due to: dg_rho0_types.o /build/reproducible-path/cp2k-8.1/src/pw/dg_rho0_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod pw_grid_types.mod pw_types.mod kinds.mod pw_methods.mod base_hooks.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dg_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/dg_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dg_rho0_types.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw/dg_types.F dg_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dg_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dg_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:45:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw/dg_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dg_types.F90 /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a' due to: rs_methods.o realspace_grid_types.o realspace_grid_cube.o pw_types.o pw_spline_utils.o pw_pool_types.o pw_poisson_types.o pw_poisson_methods.o pw_methods.o pw_grids.o pw_grid_types.o pw_grid_info.o pw_fpga.o pw_cuda.o ps_wavelet_util.o ps_wavelet_types.o ps_wavelet_scaling_function.o ps_wavelet_methods.o ps_wavelet_kernel.o ps_wavelet_fft3d.o ps_wavelet_base.o ps_implicit_types.o ps_implicit_methods.o mt_util.o lazy.o fft_tools.o fast.o dirichlet_bc_types.o dirichlet_bc_methods.o dielectric_types.o dielectric_methods.o dgs.o dg_types.o dg_rho0_types.o dct.o cube_utils.o cp_linked_list_pw.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a" Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a @@ -4103,7 +4138,7 @@ ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/reproducible-path/cp2k-8.1/Makefile:508: update target 'opencl_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fpga/opencl_utils.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/pw/fpga/opencl_utils.c -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'fft_fpga.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fpga/fft_fpga.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/pw/fpga/opencl_utils.h /build/reproducible-path/cp2k-8.1/src/pw/fpga/fft_fpga.h +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'fft_fpga.o' due to: /build/reproducible-path/cp2k-8.1/src/pw/fpga/fft_fpga.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/pw/fpga/fft_fpga.h /build/reproducible-path/cp2k-8.1/src/pw/fpga/opencl_utils.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/pw/fpga/fft_fpga.c /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a' due to: opencl_utils.o fft_fpga.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a" @@ -4111,19 +4146,19 @@ ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a opencl_utils.o fft_fpga.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:151: update target '/build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/grid_miniapp.psmp' due to: grid_miniapp.o /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a -mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/grid_miniapp.psmp grid_miniapp.o -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -lcp2ksubsys -lcp2kfm -lcp2kao -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kcommon -lcp2kmpiwrap -lcp2kfpga -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa -/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_unittest.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/grid_unittest.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/grid_replay.h +mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:45:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/grid_miniapp.psmp grid_miniapp.o -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -lcp2ksubsys -lcp2kfm -lcp2kao -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kcommon -lcp2kmpiwrap -lcp2kfpga -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa +/build/reproducible-path/cp2k-8.1/Makefile:508: update target 'grid_unittest.o' due to: /build/reproducible-path/cp2k-8.1/src/grid/grid_unittest.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/reproducible-path/cp2k-8.1/src/grid/common/grid_library.h /build/reproducible-path/cp2k-8.1/src/grid/grid_replay.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_sphere_cache.h /build/reproducible-path/cp2k-8.1/src/grid/common/grid_constants.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/grid/grid_unittest.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:147: update target '/build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/grid_unittest.psmp' due to: grid_unittest.o /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a -mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/grid_unittest.psmp grid_unittest.o -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -lcp2ksubsys -lcp2kfm -lcp2kao -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kcommon -lcp2kmpiwrap -lcp2kfpga -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'graph_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:45:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/grid_unittest.psmp grid_unittest.o -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -lcp2ksubsys -lcp2kfm -lcp2kao -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kcommon -lcp2kmpiwrap -lcp2kfpga -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'graph_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph_utils.F graph_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadyn_tools/graph_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/metadyn_tools/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' graph_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'graph_utils.mod' due to: graph_utils.o /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:45:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadyn_tools/graph_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/metadyn_tools/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' graph_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'graph_utils.mod' due to: graph_utils.o /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'graph_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 string_utilities.mod periodic_table.mod graph_utils.mod base_hooks.mod cp_files.mod physcon.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'graph_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod cp_files.mod graph_utils.mod physcon.mod string_utilities.mod periodic_table.mod memory_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph_methods.F graph_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadyn_tools/graph_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/metadyn_tools/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' graph_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:45:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadyn_tools/graph_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/metadyn_tools/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' graph_methods.F90 /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph_methods.F:499:94: 499 | dx(:, irep) = dx(:, irep) + 0.5_dp*mep_input_data%kb*(yy0 - avg2)*(dyy - davg2) @@ -4139,11 +4174,11 @@ 174 | array(ind) = MINVAL(-fes(pnt:pnt + dimval - 1)) | ^ Warning: 'ind' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'graph_methods.mod' due to: graph_methods.o /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 string_utilities.mod periodic_table.mod graph_utils.mod base_hooks.mod cp_files.mod physcon.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'graph_methods.mod' due to: graph_methods.o /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod cp_files.mod graph_utils.mod physcon.mod string_utilities.mod periodic_table.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'graph.o' due to: /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 graph_utils.mod base_hooks.mod mathconstants.mod graph_methods.mod cp_files.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'graph.o' due to: /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod cp_files.mod graph_methods.mod graph_utils.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph.F graph.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:46:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadyn_tools/graph.F\"" -I'/build/reproducible-path/cp2k-8.1/src/metadyn_tools/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' graph.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:45:37 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadyn_tools/graph.F\"" -I'/build/reproducible-path/cp2k-8.1/src/metadyn_tools/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' graph.F90 /build/reproducible-path/cp2k-8.1/src/metadyn_tools/graph.F:658:28: 658 | out3 = out2//"." @@ -4211,10 +4246,10 @@ ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmetadyn_tools.a graph_utils.o graph_methods.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmetadyn_tools.a /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:131: update target '/build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/graph.psmp' due to: graph.o /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmetadyn_tools.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a -mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/graph.psmp graph.o -lcp2kmetadyn_tools -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa +mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:45:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/graph.psmp graph.o -lcp2kmetadyn_tools -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dumpdcd.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/dumpdcd.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/dumpdcd.F dumpdcd.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/dumpdcd.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dumpdcd.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:45:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/dumpdcd.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dumpdcd.F90 /build/reproducible-path/cp2k-8.1/src/motion/dumpdcd.F:710:118: 710 | WRITE (UNIT=output_unit, FMT=fmt_string) ADJUSTL(atomic_label(iatom)), s_pbc(iatom, 1:3) @@ -4256,151 +4291,144 @@ 668 | WRITE (UNIT=output_unit) REAL(atomic_displacement(:), KIND=sp) | ^ Warning: 'atomic_displacement.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'metadynamics_types.o' due to: /build/reproducible-path/cp2k-8.1/src/metadynamics_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod parallel_rng_types.mod base_hooks.mod cp_para_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_subsys_types.mod' due to: cp_subsys_types.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'metadynamics_types.o' due to: /build/reproducible-path/cp2k-8.1/src/metadynamics_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod input_section_types.mod kinds.mod cp_para_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/metadynamics_types.F metadynamics_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadynamics_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' metadynamics_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'metadynamics_types.mod' due to: metadynamics_types.o /build/reproducible-path/cp2k-8.1/src/metadynamics_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod parallel_rng_types.mod base_hooks.mod cp_para_env.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadynamics_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' metadynamics_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'metadynamics_types.mod' due to: metadynamics_types.o /build/reproducible-path/cp2k-8.1/src/metadynamics_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod input_section_types.mod kinds.mod cp_para_env.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_subsys_types.mod' due to: cp_subsys_types.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_constants.o' due to: /build/reproducible-path/cp2k-8.1/src/input_constants.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_constants.F input_constants.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_constants.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_constants.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_constants.mod' due to: input_constants.o /build/reproducible-path/cp2k-8.1/src/input_constants.F kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'extended_system_types.o' due to: /build/reproducible-path/cp2k-8.1/src/extended_system_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod kinds.mod input_constants.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/extended_system_types.F extended_system_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"extended_system_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' extended_system_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'extended_system_types.mod' due to: extended_system_types.o /build/reproducible-path/cp2k-8.1/src/extended_system_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod kinds.mod input_constants.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'global_types.o' due to: /build/reproducible-path/cp2k-8.1/src/global_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod kinds.mod cp_blacs_env.mod machine.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/global_types.F global_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"global_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' global_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'global_types.mod' due to: global_types.o /build/reproducible-path/cp2k-8.1/src/global_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod kinds.mod cp_blacs_env.mod machine.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'simpar_types.o' due to: /build/reproducible-path/cp2k-8.1/src/simpar_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'simpar_types.o' due to: /build/reproducible-path/cp2k-8.1/src/simpar_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/simpar_types.F simpar_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"simpar_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' simpar_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'simpar_types.mod' due to: simpar_types.o /build/reproducible-path/cp2k-8.1/src/simpar_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"simpar_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' simpar_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'simpar_types.mod' due to: simpar_types.o /build/reproducible-path/cp2k-8.1/src/simpar_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_neighbor_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 util.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F qs_neighbor_list_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_neighbor_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_neighbor_list_types.F90 -/build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F:334:28: - - 334 | iterator%nnode = nnode - | ^ -Warning: 'nnode' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F:339:45: - - 339 | iterator%neighbor_list => neighbor_list - | ^ -Warning: 'neighbor_list' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F:332:28: - - 332 | iterator%nlist = nlist - | ^ -Warning: 'nlist' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F:331:28: - - 331 | iterator%ilist = ilist - | ^ -Warning: 'ilist' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F:227:61: - - 227 | list_search(il)%atom_list(ilist) = iatom - | ^ -Warning: 'iatom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_neighbor_list_types.mod' due to: qs_neighbor_list_types.o /build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 util.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_efield_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_efield_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_efield_types.F fist_efield_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_efield_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_efield_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_efield_types.mod' due to: fist_efield_types.o /build/reproducible-path/cp2k-8.1/src/fist_efield_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dispersion_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dispersion_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod input_section_types.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dispersion_types.F qs_dispersion_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dispersion_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dispersion_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dispersion_types.mod' due to: qs_dispersion_types.o /build/reproducible-path/cp2k-8.1/src/qs_dispersion_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod input_section_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_rsgrid.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_rsgrid.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod realspace_grid_types.mod kinds.mod string_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_rsgrid.F input_cp2k_rsgrid.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_rsgrid.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_rsgrid.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_rsgrid.mod' due to: input_cp2k_rsgrid.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_rsgrid.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod realspace_grid_types.mod kinds.mod string_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_constants.o' due to: /build/reproducible-path/cp2k-8.1/src/input_constants.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_constants.F input_constants.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_constants.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_constants.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_constants.mod' due to: input_constants.o /build/reproducible-path/cp2k-8.1/src/input_constants.F kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_spline_utils.mod' due to: pw_spline_utils.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_upf.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_upf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod periodic_table.mod base_hooks.mod kinds.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_upf.F atom_upf.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_upf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_upf.F90 -/build/reproducible-path/cp2k-8.1/src/atom_upf.F:519:33: - - 519 | ALLOCATE (pot%rab(m)) - | ^ -Warning: 'm' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/atom_upf.F:447:69: - - 447 | INTEGER :: icount, m, mc, ms - | ^ -note: 'm' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_upf.mod' due to: atom_upf.o /build/reproducible-path/cp2k-8.1/src/atom_upf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod periodic_table.mod base_hooks.mod kinds.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_poisson.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_poisson.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod dielectric_types.mod pw_poisson_types.mod ps_implicit_types.mod input_keyword_types.mod input_val_types.mod dirichlet_bc_types.mod input_section_types.mod multipole_types.mod kinds.mod cp_output_handling.mod bibliography.mod input_cp2k_rsgrid.mod string_utilities.mod dct.mod base_hooks.mod input_constants.mod pw_spline_utils.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_poisson.F input_cp2k_poisson.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_poisson.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_poisson.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_poisson.mod' due to: input_cp2k_poisson.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_poisson.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod dielectric_types.mod pw_poisson_types.mod ps_implicit_types.mod input_keyword_types.mod input_val_types.mod dirichlet_bc_types.mod input_section_types.mod multipole_types.mod kinds.mod cp_output_handling.mod bibliography.mod input_cp2k_rsgrid.mod string_utilities.mod dct.mod base_hooks.mod input_constants.mod pw_spline_utils.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_grid_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_grid_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_constants.mod base_hooks.mod mathconstants.mod lebedev.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_grid_atom.F qs_grid_atom.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_grid_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_grid_atom.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_grid_atom.mod' due to: qs_grid_atom.o /build/reproducible-path/cp2k-8.1/src/qs_grid_atom.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_constants.mod base_hooks.mod mathconstants.mod lebedev.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewald_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/ewald_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod cp_para_types.mod input_enumeration_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_poisson.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod cp_para_env.mod pw_grid_info.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewald_environment_types.F ewald_environment_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_environment_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewald_environment_types.mod' due to: ewald_environment_types.o /build/reproducible-path/cp2k-8.1/src/ewald_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod cp_para_types.mod input_enumeration_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_poisson.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod cp_para_env.mod pw_grid_info.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_types.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod periodic_table.mod string_utilities.mod base_hooks.mod mathconstants.mod atom_upf.mod bibliography.mod bessel_lib.mod qs_grid_atom.mod kinds.mod cp_linked_list_input.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_types.F atom_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_types.F90 -/build/reproducible-path/cp2k-8.1/src/atom_types.F:2905:56: - - 2905 | potential%npot(l) = potential%npot(l) + 1 - | ^ -Warning: 'l' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_types.mod' due to: atom_types.o /build/reproducible-path/cp2k-8.1/src/atom_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod periodic_table.mod string_utilities.mod base_hooks.mod mathconstants.mod atom_upf.mod bibliography.mod bessel_lib.mod qs_grid_atom.mod kinds.mod cp_linked_list_input.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dg_types.mod' due to: dg_types.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dftb_types.F qs_dftb_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb_types.mod' due to: qs_dftb_types.o /build/reproducible-path/cp2k-8.1/src/qs_dftb_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_poisson_methods.mod' due to: pw_poisson_methods.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_cdft_opt_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_cdft_opt_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_cdft_opt_types.F qs_cdft_opt_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_opt_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_opt_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_cdft_opt_types.mod' due to: qs_cdft_opt_types.o /build/reproducible-path/cp2k-8.1/src/qs_cdft_opt_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dgs.mod' due to: dgs.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hirshfeld_types.o' due to: /build/reproducible-path/cp2k-8.1/src/hirshfeld_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod input_constants.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hirshfeld_types.F hirshfeld_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hirshfeld_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hirshfeld_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hirshfeld_types.mod' due to: hirshfeld_types.o /build/reproducible-path/cp2k-8.1/src/hirshfeld_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod input_constants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_realspace_grid_init.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_realspace_grid_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod realspace_grid_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_realspace_grid_init.F cp_realspace_grid_init.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_realspace_grid_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_realspace_grid_init.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_realspace_grid_init.mod' due to: cp_realspace_grid_init.o /build/reproducible-path/cp2k-8.1/src/cp_realspace_grid_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod realspace_grid_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'outer_scf_control_types.o' due to: /build/reproducible-path/cp2k-8.1/src/outer_scf_control_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_cdft_opt_types.mod input_section_types.mod input_constants.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/outer_scf_control_types.F outer_scf_control_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"outer_scf_control_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' outer_scf_control_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'outer_scf_control_types.mod' due to: outer_scf_control_types.o /build/reproducible-path/cp2k-8.1/src/outer_scf_control_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_cdft_opt_types.mod input_section_types.mod input_constants.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_poisson_read_input.o' due to: /build/reproducible-path/cp2k-8.1/src/pw_poisson_read_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod ps_wavelet_types.mod dirichlet_bc_types.mod cell_types.mod input_section_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw_poisson_read_input.F pw_poisson_read_input.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_poisson_read_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_poisson_read_input.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_poisson_read_input.mod' due to: pw_poisson_read_input.o /build/reproducible-path/cp2k-8.1/src/pw_poisson_read_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod ps_wavelet_types.mod dirichlet_bc_types.mod cell_types.mod input_section_types.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_cdft_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_cdft_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_cdft_opt_types.mod pw_types.mod hirshfeld_types.mod outer_scf_control_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod cp_array_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_cdft_types.F qs_cdft_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_types.F90 -/build/reproducible-path/cp2k-8.1/src/qs_cdft_types.F:501:33: - - 501 | SUBROUTINE cdft_control_retain(cdft_control) - | ^ -Warning: 'cdft_control_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_cdft_types.mod' due to: qs_cdft_types.o /build/reproducible-path/cp2k-8.1/src/qs_cdft_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_cdft_opt_types.mod pw_types.mod hirshfeld_types.mod outer_scf_control_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod cp_array_utils.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewald_pw_types.o' due to: /build/reproducible-path/cp2k-8.1/src/ewald_pw_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod cell_types.mod pw_poisson_types.mod pw_grid_types.mod ewald_environment_types.mod dg_types.mod input_section_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod pw_grids.mod cp_output_handling.mod message_passing.mod pw_poisson_methods.mod dgs.mod cp_realspace_grid_init.mod pw_poisson_read_input.mod base_hooks.mod mathconstants.mod ao_util.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewald_pw_types.F ewald_pw_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:24 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_pw_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_pw_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewald_pw_types.mod' due to: ewald_pw_types.o /build/reproducible-path/cp2k-8.1/src/ewald_pw_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod cell_types.mod pw_poisson_types.mod pw_grid_types.mod ewald_environment_types.mod dg_types.mod input_section_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod pw_grids.mod cp_output_handling.mod message_passing.mod pw_poisson_methods.mod dgs.mod cp_realspace_grid_init.mod pw_poisson_read_input.mod base_hooks.mod mathconstants.mod ao_util.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_gaussian_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_types.F qmmm_gaussian_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gaussian_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gaussian_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_gaussian_types.mod' due to: qmmm_gaussian_types.o /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'splines_types.o' due to: /build/reproducible-path/cp2k-8.1/src/splines_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'splines_types.o' due to: /build/reproducible-path/cp2k-8.1/src/splines_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/splines_types.F splines_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"splines_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' splines_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"splines_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' splines_types.F90 /build/reproducible-path/cp2k-8.1/src/splines_types.F:193:31: 193 | SUBROUTINE spline_env_retain(spline_env) | ^ Warning: 'spline_env_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'splines_types.mod' due to: splines_types.o /build/reproducible-path/cp2k-8.1/src/splines_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'splines_types.mod' due to: splines_types.o /build/reproducible-path/cp2k-8.1/src/splines_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pair_potential_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pair_potential_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod base_hooks.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pair_potential_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pair_potential_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod base_hooks.mod memory_utilities.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pair_potential_types.F pair_potential_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pair_potential_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pair_potential_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pair_potential_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pair_potential_types.F90 /build/reproducible-path/cp2k-8.1/src/pair_potential_types.F:817:69: 817 | INTEGER :: i, loc_lb, loc_ub | ^ Warning: 'loc_lb' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pair_potential_types.mod' due to: pair_potential_types.o /build/reproducible-path/cp2k-8.1/src/pair_potential_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod base_hooks.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pair_potential_types.mod' due to: pair_potential_types.o /build/reproducible-path/cp2k-8.1/src/pair_potential_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod base_hooks.mod memory_utilities.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_field_types.o' due to: /build/reproducible-path/cp2k-8.1/src/force_field_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod shell_potential_types.mod damping_dipole_types.mod force_field_kind_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/force_field_types.F force_field_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_field_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_field_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_field_types.mod' due to: force_field_types.o /build/reproducible-path/cp2k-8.1/src/force_field_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod shell_potential_types.mod damping_dipole_types.mod force_field_kind_types.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hirshfeld_types.o' due to: /build/reproducible-path/cp2k-8.1/src/hirshfeld_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod base_hooks.mod input_constants.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hirshfeld_types.F hirshfeld_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hirshfeld_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hirshfeld_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hirshfeld_types.mod' due to: hirshfeld_types.o /build/reproducible-path/cp2k-8.1/src/hirshfeld_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod base_hooks.mod input_constants.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_cdft_opt_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_cdft_opt_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod input_constants.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_cdft_opt_types.F qs_cdft_opt_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_opt_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_opt_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_cdft_opt_types.mod' due to: qs_cdft_opt_types.o /build/reproducible-path/cp2k-8.1/src/qs_cdft_opt_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod input_constants.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'outer_scf_control_types.o' due to: /build/reproducible-path/cp2k-8.1/src/outer_scf_control_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_cdft_opt_types.mod input_section_types.mod kinds.mod input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/outer_scf_control_types.F outer_scf_control_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"outer_scf_control_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' outer_scf_control_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'outer_scf_control_types.mod' due to: outer_scf_control_types.o /build/reproducible-path/cp2k-8.1/src/outer_scf_control_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_cdft_opt_types.mod input_section_types.mod kinds.mod input_constants.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_cdft_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_cdft_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hirshfeld_types.mod pw_types.mod qs_cdft_opt_types.mod outer_scf_control_types.mod cp_fm_types.mod cp_array_utils.mod kinds.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_cdft_types.F qs_cdft_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_types.F90 +/build/reproducible-path/cp2k-8.1/src/qs_cdft_types.F:501:33: + + 501 | SUBROUTINE cdft_control_retain(cdft_control) + | ^ +Warning: 'cdft_control_retain' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_cdft_types.mod' due to: qs_cdft_types.o /build/reproducible-path/cp2k-8.1/src/qs_cdft_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hirshfeld_types.mod pw_types.mod qs_cdft_opt_types.mod outer_scf_control_types.mod cp_fm_types.mod cp_array_utils.mod kinds.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_control.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_control.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_log_handling.mod kinds.mod input_constants.mod cp_output_handling.mod memory_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_control.F xas_control.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_control.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_control.F90 /build/reproducible-path/cp2k-8.1/src/xas_control.F:326:32: 326 | SUBROUTINE xas_control_retain(xas_control) | ^ Warning: 'xas_control_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_control.mod' due to: xas_control.o /build/reproducible-path/cp2k-8.1/src/xas_control.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_control.mod' due to: xas_control.o /build/reproducible-path/cp2k-8.1/src/xas_control.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_log_handling.mod kinds.mod input_constants.mod cp_output_handling.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_control_types.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_control_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod pair_potential_types.mod cp_fm_types.mod input_constants.mod xas_control.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_control_types.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_control_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod qs_cdft_types.mod cp_fm_types.mod xas_control.mod kinds.mod input_constants.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_control_types.F cp_control_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_control_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_control_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_control_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_control_types.F90 /build/reproducible-path/cp2k-8.1/src/cp_control_types.F:654:37: 654 | SUBROUTINE mulliken_control_retain(mulliken_restraint_control) @@ -4416,74 +4444,183 @@ 770 | SUBROUTINE s2_control_retain(s2_restraint_control) | ^ Warning: 's2_control_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_control_types.mod' due to: cp_control_types.o /build/reproducible-path/cp2k-8.1/src/cp_control_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_cdft_types.mod pair_potential_types.mod cp_fm_types.mod input_constants.mod xas_control.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_control_types.mod' due to: cp_control_types.o /build/reproducible-path/cp2k-8.1/src/cp_control_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod qs_cdft_types.mod cp_fm_types.mod xas_control.mod kinds.mod input_constants.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'paw_proj_set_types.o' due to: /build/reproducible-path/cp2k-8.1/src/paw_proj_set_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod input_section_types.mod cp_control_types.mod ao_util.mod mathlib.mod cp_log_handling.mod mathconstants.mod base_hooks.mod cp_output_handling.mod orbital_transformation_matrices.mod orbital_pointers.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'paw_proj_set_types.o' due to: /build/reproducible-path/cp2k-8.1/src/paw_proj_set_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_control_types.mod input_section_types.mod mathlib.mod ao_util.mod cp_log_handling.mod kinds.mod mathconstants.mod orbital_pointers.mod orbital_transformation_matrices.mod cp_output_handling.mod memory_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/paw_proj_set_types.F paw_proj_set_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"paw_proj_set_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' paw_proj_set_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'paw_proj_set_types.mod' due to: paw_proj_set_types.o /build/reproducible-path/cp2k-8.1/src/paw_proj_set_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod input_section_types.mod cp_control_types.mod ao_util.mod mathlib.mod cp_log_handling.mod mathconstants.mod base_hooks.mod cp_output_handling.mod orbital_transformation_matrices.mod orbital_pointers.mod kinds.mod memory_utilities.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:46:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"paw_proj_set_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' paw_proj_set_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'paw_proj_set_types.mod' due to: paw_proj_set_types.o /build/reproducible-path/cp2k-8.1/src/paw_proj_set_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_control_types.mod input_section_types.mod mathlib.mod ao_util.mod cp_log_handling.mod kinds.mod mathconstants.mod orbital_pointers.mod orbital_transformation_matrices.mod cp_output_handling.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'basis_set_container_types.mod' due to: basis_set_container_types.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dg_types.mod' due to: dg_types.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_expns3_types.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_expns3_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_expns3_types.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_expns3_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_expns3_types.F semi_empirical_expns3_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_expns3_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_expns3_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_expns3_types.mod' due to: semi_empirical_expns3_types.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_expns3_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:47:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_expns3_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_expns3_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_expns3_types.mod' due to: semi_empirical_expns3_types.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_expns3_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_mpole_types.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_mpole_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_mpole_types.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_mpole_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_mpole_types.F semi_empirical_mpole_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_mpole_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_mpole_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_mpole_types.mod' due to: semi_empirical_mpole_types.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_mpole_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:47:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_mpole_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_mpole_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_mpole_types.mod' due to: semi_empirical_mpole_types.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_mpole_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'taper_types.o' due to: /build/reproducible-path/cp2k-8.1/src/taper_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'taper_types.o' due to: /build/reproducible-path/cp2k-8.1/src/taper_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/taper_types.F taper_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"taper_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' taper_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'taper_types.mod' due to: taper_types.o /build/reproducible-path/cp2k-8.1/src/taper_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:47:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"taper_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' taper_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'taper_types.mod' due to: taper_types.o /build/reproducible-path/cp2k-8.1/src/taper_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_types.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod dg_types.mod multipole_types.mod input_section_types.mod semi_empirical_expns3_types.mod pw_pool_types.mod semi_empirical_mpole_types.mod taper_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_types.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_expns3_types.mod basis_set_types.mod pw_pool_types.mod semi_empirical_mpole_types.mod multipole_types.mod taper_types.mod dg_types.mod input_section_types.mod cp_log_handling.mod kinds.mod input_constants.mod physcon.mod cp_output_handling.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_types.F semi_empirical_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:47:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_types.F90 /build/reproducible-path/cp2k-8.1/src/semi_empirical_types.F:456:26: 456 | SUBROUTINE set_se_param(sep, name, typ, defined, z, zeff, natorb, eheat, & | ^ Warning: 'set_se_param' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_types.mod' due to: semi_empirical_types.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod dg_types.mod multipole_types.mod input_section_types.mod semi_empirical_expns3_types.mod pw_pool_types.mod semi_empirical_mpole_types.mod taper_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_types.mod' due to: semi_empirical_types.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_expns3_types.mod basis_set_types.mod pw_pool_types.mod semi_empirical_mpole_types.mod multipole_types.mod taper_types.mod dg_types.mod input_section_types.mod cp_log_handling.mod kinds.mod input_constants.mod physcon.mod cp_output_handling.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_grid_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_grid_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod input_constants.mod lebedev.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_grid_atom.F qs_grid_atom.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:47:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_grid_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_grid_atom.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_grid_atom.mod' due to: qs_grid_atom.o /build/reproducible-path/cp2k-8.1/src/qs_grid_atom.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod input_constants.mod lebedev.mod memory_utilities.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_upf.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_upf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod kinds.mod periodic_table.mod cp_parser_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_upf.F atom_upf.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:47:26 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_upf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_upf.F90 +/build/reproducible-path/cp2k-8.1/src/atom_upf.F:519:33: + + 519 | ALLOCATE (pot%rab(m)) + | ^ +Warning: 'm' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/atom_upf.F:447:69: + + 447 | INTEGER :: icount, m, mc, ms + | ^ +note: 'm' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_upf.mod' due to: atom_upf.o /build/reproducible-path/cp2k-8.1/src/atom_upf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod kinds.mod periodic_table.mod cp_parser_methods.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_types.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cp_parser_types.mod input_section_types.mod mathconstants.mod cp_linked_list_input.mod kinds.mod base_hooks.mod bessel_lib.mod input_constants.mod string_utilities.mod periodic_table.mod qs_grid_atom.mod atom_upf.mod cp_parser_methods.mod bibliography.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_types.F atom_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:47:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_types.F90 +/build/reproducible-path/cp2k-8.1/src/atom_types.F:2905:56: + + 2905 | potential%npot(l) = potential%npot(l) + 1 + | ^ +Warning: 'l' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_types.mod' due to: atom_types.o /build/reproducible-path/cp2k-8.1/src/atom_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cp_parser_types.mod input_section_types.mod mathconstants.mod cp_linked_list_input.mod kinds.mod base_hooks.mod bessel_lib.mod input_constants.mod string_utilities.mod periodic_table.mod qs_grid_atom.mod atom_upf.mod cp_parser_methods.mod bibliography.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_neighbor_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F qs_neighbor_list_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:47:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_neighbor_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_neighbor_list_types.F90 +/build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F:334:28: + + 334 | iterator%nnode = nnode + | ^ +Warning: 'nnode' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F:339:45: + + 339 | iterator%neighbor_list => neighbor_list + | ^ +Warning: 'neighbor_list' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F:332:28: + + 332 | iterator%nlist = nlist + | ^ +Warning: 'nlist' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F:331:28: + + 331 | iterator%ilist = ilist + | ^ +Warning: 'ilist' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F:227:61: + + 227 | list_search(il)%atom_list(ilist) = iatom + | ^ +Warning: 'iatom' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_neighbor_list_types.mod' due to: qs_neighbor_list_types.o /build/reproducible-path/cp2k-8.1/src/qs_neighbor_list_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod util.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xtb_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xtb_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dispersion_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dispersion_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_neighbor_list_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dispersion_types.F qs_dispersion_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:47:56 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dispersion_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dispersion_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dispersion_types.mod' due to: qs_dispersion_types.o /build/reproducible-path/cp2k-8.1/src/qs_dispersion_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_neighbor_list_types.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xtb_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xtb_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xtb_types.F xtb_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xtb_types.mod' due to: xtb_types.o /build/reproducible-path/cp2k-8.1/src/xtb_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:47:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xtb_types.mod' due to: xtb_types.o /build/reproducible-path/cp2k-8.1/src/xtb_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_harmonics_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_harmonics_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod spherical_harmonics.mod base_hooks.mod lebedev.mod orbital_transformation_matrices.mod orbital_pointers.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_harmonics_atom.F qs_harmonics_atom.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_harmonics_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_harmonics_atom.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_harmonics_atom.mod' due to: qs_harmonics_atom.o /build/reproducible-path/cp2k-8.1/src/qs_harmonics_atom.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod spherical_harmonics.mod base_hooks.mod lebedev.mod orbital_transformation_matrices.mod orbital_pointers.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dftb_types.F qs_dftb_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:47:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb_types.mod' due to: qs_dftb_types.o /build/reproducible-path/cp2k-8.1/src/qs_dftb_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_dftb_types.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'basis_set_container_types.mod' due to: basis_set_container_types.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_dftb_types.mod input_section_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dftb_utils.F qs_dftb_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb_utils.mod' due to: qs_dftb_utils.o /build/reproducible-path/cp2k-8.1/src/qs_dftb_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_dftb_types.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:48:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb_utils.mod' due to: qs_dftb_utils.o /build/reproducible-path/cp2k-8.1/src/qs_dftb_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_dftb_types.mod input_section_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_harmonics_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_harmonics_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod kinds.mod orbital_pointers.mod orbital_transformation_matrices.mod spherical_harmonics.mod lebedev.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_harmonics_atom.F qs_harmonics_atom.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:48:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_harmonics_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_harmonics_atom.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_harmonics_atom.mod' due to: qs_harmonics_atom.o /build/reproducible-path/cp2k-8.1/src/qs_harmonics_atom.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod kinds.mod orbital_pointers.mod orbital_transformation_matrices.mod spherical_harmonics.mod lebedev.mod memory_utilities.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_arrays.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_arrays.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_arrays.F semi_empirical_int_arrays.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:48:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_arrays.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_arrays.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_arrays.mod' due to: semi_empirical_int_arrays.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_arrays.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_par_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod mathlib.mod mathconstants.mod kinds.mod physcon.mod semi_empirical_int_arrays.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F semi_empirical_par_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:48:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_par_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_par_utils.F90 +/build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F:985:10: + + 985 | IF (f1 >= f2) THEN + | ^ +Warning: 'f2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F:985:10: Warning: 'f1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F:282:28: + + 282 | END FUNCTION get_se_basis + | ^ +Warning: 'n' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F:254:42: + + 254 | FUNCTION get_se_basis(sep, l) RESULT(n) + | ^ +note: 'n' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_par_utils.mod' due to: semi_empirical_par_utils.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod mathlib.mod mathconstants.mod kinds.mod physcon.mod semi_empirical_int_arrays.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xtb_parameters.o' due to: /build/reproducible-path/cp2k-8.1/src/xtb_parameters.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod basis_set_types.mod cp_para_types.mod input_section_types.mod xtb_types.mod cp_control_types.mod cp_parser_types.mod periodic_table.mod string_utilities.mod base_hooks.mod kinds.mod cp_linked_list_input.mod physcon.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_parameters.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_parameters.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod kinds.mod input_constants.mod physcon.mod periodic_table.mod semi_empirical_par_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_parameters.F semi_empirical_parameters.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:48:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_parameters.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_parameters.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_parameters.mod' due to: semi_empirical_parameters.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_parameters.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod kinds.mod input_constants.mod physcon.mod periodic_table.mod semi_empirical_par_utils.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_mpole_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_mpole_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod semi_empirical_mpole_types.mod kinds.mod input_constants.mod semi_empirical_int_arrays.mod semi_empirical_par_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_mpole_methods.F semi_empirical_mpole_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:48:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_mpole_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_mpole_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_mpole_methods.mod' due to: semi_empirical_mpole_methods.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_mpole_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod semi_empirical_mpole_types.mod kinds.mod input_constants.mod semi_empirical_int_arrays.mod semi_empirical_par_utils.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod basis_set_types.mod cp_control_types.mod cell_types.mod input_section_types.mod kinds.mod input_constants.mod semi_empirical_parameters.mod semi_empirical_par_utils.mod semi_empirical_mpole_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_utils.F semi_empirical_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:48:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_utils.mod' due to: semi_empirical_utils.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod basis_set_types.mod cp_control_types.mod cell_types.mod input_section_types.mod kinds.mod input_constants.mod semi_empirical_parameters.mod semi_empirical_par_utils.mod semi_empirical_mpole_methods.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xtb_parameters.o' due to: /build/reproducible-path/cp2k-8.1/src/xtb_parameters.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod basis_set_types.mod input_val_types.mod cp_control_types.mod cp_parser_types.mod xtb_types.mod input_section_types.mod cp_linked_list_input.mod kinds.mod physcon.mod string_utilities.mod periodic_table.mod cp_parser_methods.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xtb_parameters.F xtb_parameters.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_parameters.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_parameters.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:49:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_parameters.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_parameters.F90 /build/reproducible-path/cp2k-8.1/src/xtb_parameters.F:206:21: 206 | enam = aname | 1 Warning: CHARACTER expression will be truncated in assignment (2/80) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xtb_parameters.mod' due to: xtb_parameters.o /build/reproducible-path/cp2k-8.1/src/xtb_parameters.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod basis_set_types.mod cp_para_types.mod input_section_types.mod xtb_types.mod cp_control_types.mod cp_parser_types.mod periodic_table.mod string_utilities.mod base_hooks.mod kinds.mod cp_linked_list_input.mod physcon.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xtb_parameters.mod' due to: xtb_parameters.o /build/reproducible-path/cp2k-8.1/src/xtb_parameters.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod basis_set_types.mod input_val_types.mod cp_control_types.mod cp_parser_types.mod xtb_types.mod input_section_types.mod cp_linked_list_input.mod kinds.mod physcon.mod string_utilities.mod periodic_table.mod cp_parser_methods.mod base_hooks.mod true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_onecenter.mod' due to: ai_onecenter.o true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'splines.mod' due to: splines.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atom_types.mod input_constants.mod string_utilities.mod lapack.mod mathconstants.mod cp_files.mod kinds.mod kahan_sum.mod physcon.mod ao_util.mod ai_overlap.mod splines.mod qs_grid_atom.mod ai_onecenter.mod periodic_table.mod mathlib.mod base_hooks.mod orbital_transformation_matrices.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod basis_set_types.mod kinds.mod orbital_transformation_matrices.mod physcon.mod periodic_table.mod ai_overlap.mod kahan_sum.mod ai_onecenter.mod string_utilities.mod qs_grid_atom.mod mathlib.mod lapack.mod cp_files.mod orbital_pointers.mod base_hooks.mod mathconstants.mod ao_util.mod splines.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_utils.F atom_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:49:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_utils.F90 /build/reproducible-path/cp2k-8.1/src/atom_utils.F:983:3: 983 | FUNCTION prune_grid(fun, deps) RESULT(nc) @@ -4504,13 +4641,13 @@ 2268 | IF (spinpol) THEN | ^ Warning: 'spinpol' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_utils.mod' due to: atom_utils.o /build/reproducible-path/cp2k-8.1/src/atom_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atom_types.mod input_constants.mod string_utilities.mod lapack.mod mathconstants.mod cp_files.mod kinds.mod kahan_sum.mod physcon.mod ao_util.mod ai_overlap.mod splines.mod qs_grid_atom.mod ai_onecenter.mod periodic_table.mod mathlib.mod base_hooks.mod orbital_transformation_matrices.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_utils.mod' due to: atom_utils.o /build/reproducible-path/cp2k-8.1/src/atom_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod basis_set_types.mod kinds.mod orbital_transformation_matrices.mod physcon.mod periodic_table.mod ai_overlap.mod kahan_sum.mod ai_onecenter.mod string_utilities.mod qs_grid_atom.mod mathlib.mod lapack.mod cp_files.mod orbital_pointers.mod base_hooks.mod mathconstants.mod ao_util.mod splines.mod input_constants.mod true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'powell.mod' due to: powell.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_sgp.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_sgp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod input_constants.mod ai_onecenter.mod mathlib.mod base_hooks.mod mathconstants.mod atom_utils.mod atom_upf.mod powell.mod kinds.mod kahan_sum.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_sgp.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_sgp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod mathlib.mod kahan_sum.mod mathconstants.mod kinds.mod atom_utils.mod ai_onecenter.mod input_constants.mod powell.mod atom_upf.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_sgp.F atom_sgp.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:47:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_sgp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_sgp.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:49:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_sgp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_sgp.F90 /build/reproducible-path/cp2k-8.1/src/atom_sgp.F:544:13: 544 | IF (nl_trans) THEN @@ -4541,206 +4678,64 @@ 162 | error(3) = errcc | ^ Warning: 'errcc' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_sgp.mod' due to: atom_sgp.o /build/reproducible-path/cp2k-8.1/src/atom_sgp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod input_constants.mod ai_onecenter.mod mathlib.mod base_hooks.mod mathconstants.mod atom_utils.mod atom_upf.mod powell.mod kinds.mod kahan_sum.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_arrays.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_arrays.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_arrays.F semi_empirical_int_arrays.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:00 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_arrays.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_arrays.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_arrays.mod' due to: semi_empirical_int_arrays.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_arrays.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_par_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod mathlib.mod base_hooks.mod mathconstants.mod semi_empirical_int_arrays.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F semi_empirical_par_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_par_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_par_utils.F90 -/build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F:985:10: - - 985 | IF (f1 >= f2) THEN - | ^ -Warning: 'f2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F:985:10: Warning: 'f1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F:282:28: - - 282 | END FUNCTION get_se_basis - | ^ -Warning: 'n' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F:254:42: - - 254 | FUNCTION get_se_basis(sep, l) RESULT(n) - | ^ -note: 'n' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_par_utils.mod' due to: semi_empirical_par_utils.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_par_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod mathlib.mod base_hooks.mod mathconstants.mod semi_empirical_int_arrays.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_mpole_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_mpole_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_mpole_types.mod semi_empirical_types.mod input_constants.mod semi_empirical_par_utils.mod base_hooks.mod semi_empirical_int_arrays.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_mpole_methods.F semi_empirical_mpole_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_mpole_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_mpole_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_mpole_methods.mod' due to: semi_empirical_mpole_methods.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_mpole_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_mpole_types.mod semi_empirical_types.mod input_constants.mod semi_empirical_par_utils.mod base_hooks.mod semi_empirical_int_arrays.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_parameters.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_parameters.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod input_constants.mod periodic_table.mod semi_empirical_par_utils.mod base_hooks.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_parameters.F semi_empirical_parameters.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_parameters.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_parameters.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_parameters.mod' due to: semi_empirical_parameters.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_parameters.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod input_constants.mod periodic_table.mod semi_empirical_par_utils.mod base_hooks.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_control_types.mod input_section_types.mod cell_types.mod semi_empirical_types.mod input_constants.mod semi_empirical_par_utils.mod base_hooks.mod semi_empirical_mpole_methods.mod semi_empirical_parameters.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_utils.F semi_empirical_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_utils.mod' due to: semi_empirical_utils.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_control_types.mod input_section_types.mod cell_types.mod semi_empirical_types.mod input_constants.mod semi_empirical_par_utils.mod base_hooks.mod semi_empirical_mpole_methods.mod semi_empirical_parameters.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_sgp.mod' due to: atom_sgp.o /build/reproducible-path/cp2k-8.1/src/atom_sgp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod mathlib.mod kahan_sum.mod mathconstants.mod kinds.mod atom_utils.mod ai_onecenter.mod input_constants.mod powell.mod atom_upf.mod base_hooks.mod true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'soft_basis_set.mod' due to: soft_basis_set.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_kind_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_kind_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_dispersion_types.mod basis_set_types.mod cp_para_types.mod atom_types.mod qs_dftb_types.mod paw_proj_set_types.mod cp_control_types.mod basis_set_container_types.mod external_potential_types.mod semi_empirical_types.mod atomic_kind_types.mod input_section_types.mod xtb_types.mod input_constants.mod string_utilities.mod mathconstants.mod kinds.mod qs_harmonics_atom.mod atom_upf.mod cp_output_handling.mod physcon.mod qs_dftb_utils.mod xtb_parameters.mod atom_sgp.mod semi_empirical_utils.mod qs_grid_atom.mod periodic_table.mod cp_log_handling.mod base_hooks.mod soft_basis_set.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_kind_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_kind_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod semi_empirical_types.mod atom_types.mod qs_dispersion_types.mod xtb_types.mod qs_dftb_types.mod atomic_kind_types.mod basis_set_types.mod external_potential_types.mod input_section_types.mod cp_control_types.mod basis_set_container_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod qs_dftb_utils.mod periodic_table.mod atom_upf.mod qs_harmonics_atom.mod string_utilities.mod qs_grid_atom.mod semi_empirical_utils.mod xtb_parameters.mod orbital_pointers.mod base_hooks.mod mathconstants.mod atom_sgp.mod input_constants.mod soft_basis_set.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_kind_types.F qs_kind_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_kind_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_kind_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_kind_types.mod' due to: qs_kind_types.o /build/reproducible-path/cp2k-8.1/src/qs_kind_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_dispersion_types.mod basis_set_types.mod cp_para_types.mod atom_types.mod qs_dftb_types.mod paw_proj_set_types.mod cp_control_types.mod basis_set_container_types.mod external_potential_types.mod semi_empirical_types.mod atomic_kind_types.mod input_section_types.mod xtb_types.mod input_constants.mod string_utilities.mod mathconstants.mod kinds.mod qs_harmonics_atom.mod atom_upf.mod cp_output_handling.mod physcon.mod qs_dftb_utils.mod xtb_parameters.mod atom_sgp.mod semi_empirical_utils.mod qs_grid_atom.mod periodic_table.mod cp_log_handling.mod base_hooks.mod soft_basis_set.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_force_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_force_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod base_hooks.mod message_passing.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_force_types.F qs_force_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_force_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_force_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_force_types.mod' due to: qs_force_types.o /build/reproducible-path/cp2k-8.1/src/qs_force_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod base_hooks.mod message_passing.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_energy_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_energy_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_energy_types.F qs_energy_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_energy_types.mod' due to: qs_energy_types.o /build/reproducible-path/cp2k-8.1/src/qs_energy_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_subsys_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_subsys_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod cell_types.mod atomic_kind_list_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod atprop_types.mod particle_list_types.mod distribution_1d_types.mod molecule_list_types.mod multipole_types.mod atomic_kind_types.mod cp_result_types.mod qs_force_types.mod colvar_types.mod molecule_types.mod qs_energy_types.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_subsys_types.F qs_subsys_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_subsys_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_subsys_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_subsys_types.mod' due to: qs_subsys_types.o /build/reproducible-path/cp2k-8.1/src/qs_subsys_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod cell_types.mod atomic_kind_list_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod atprop_types.mod particle_list_types.mod distribution_1d_types.mod molecule_list_types.mod multipole_types.mod atomic_kind_types.mod cp_result_types.mod qs_force_types.mod colvar_types.mod molecule_types.mod qs_energy_types.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pwdft_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pwdft_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod qs_subsys_types.mod cp_subsys_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pwdft_environment_types.F pwdft_environment_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pwdft_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pwdft_environment_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pwdft_environment_types.mod' due to: pwdft_environment_types.o /build/reproducible-path/cp2k-8.1/src/pwdft_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod qs_subsys_types.mod cp_subsys_types.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_energy_types.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_energy_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_energy_types.F mixed_energy_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_energy_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_energy_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_energy_types.mod' due to: mixed_energy_types.o /build/reproducible-path/cp2k-8.1/src/mixed_energy_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_energy_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_energy_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_energy_types.F fist_energy_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_energy_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_energy_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_energy_types.mod' due to: fist_energy_types.o /build/reproducible-path/cp2k-8.1/src/fist_energy_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'nnp_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/nnp_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_kind_list_types.mod molecule_list_types.mod molecule_types.mod atomic_kind_types.mod input_section_types.mod particle_types.mod virial_types.mod cp_subsys_types.mod particle_list_types.mod cell_types.mod atomic_kind_list_types.mod distribution_1d_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/nnp_environment_types.F nnp_environment_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_environment_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'nnp_environment_types.mod' due to: nnp_environment_types.o /build/reproducible-path/cp2k-8.1/src/nnp_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_kind_list_types.mod molecule_list_types.mod molecule_types.mod atomic_kind_types.mod input_section_types.mod particle_types.mod virial_types.mod cp_subsys_types.mod particle_list_types.mod cell_types.mod atomic_kind_list_types.mod distribution_1d_types.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'exclusion_types.o' due to: /build/reproducible-path/cp2k-8.1/src/exclusion_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/exclusion_types.F exclusion_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"exclusion_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' exclusion_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'exclusion_types.mod' due to: exclusion_types.o /build/reproducible-path/cp2k-8.1/src/exclusion_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_neighbor_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_neighbor_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 exclusion_types.mod cell_types.mod base_hooks.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_neighbor_list_types.F fist_neighbor_list_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_neighbor_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_neighbor_list_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_neighbor_list_types.mod' due to: fist_neighbor_list_types.o /build/reproducible-path/cp2k-8.1/src/fist_neighbor_list_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 exclusion_types.mod cell_types.mod base_hooks.mod kinds.mod memory_utilities.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_nonbond_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_nonbond_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_nonbond_env_types.F fist_nonbond_env_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:51 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_nonbond_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_nonbond_env_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_nonbond_env_types.mod' due to: fist_nonbond_env_types.o /build/reproducible-path/cp2k-8.1/src/fist_nonbond_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_rsgrid.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_rsgrid.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod realspace_grid_types.mod input_section_types.mod string_utilities.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_rsgrid.F input_cp2k_rsgrid.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_rsgrid.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_rsgrid.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_rsgrid.mod' due to: input_cp2k_rsgrid.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_rsgrid.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod realspace_grid_types.mod input_section_types.mod string_utilities.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_spline_utils.mod' due to: pw_spline_utils.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_poisson.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_poisson.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod dielectric_types.mod input_keyword_types.mod cell_types.mod dirichlet_bc_types.mod ps_implicit_types.mod pw_poisson_types.mod multipole_types.mod input_section_types.mod input_constants.mod string_utilities.mod kinds.mod cp_output_handling.mod dct.mod input_cp2k_rsgrid.mod bibliography.mod base_hooks.mod pw_spline_utils.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_poisson.F input_cp2k_poisson.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_poisson.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_poisson.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_poisson.mod' due to: input_cp2k_poisson.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_poisson.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod dielectric_types.mod input_keyword_types.mod cell_types.mod dirichlet_bc_types.mod ps_implicit_types.mod pw_poisson_types.mod multipole_types.mod input_section_types.mod input_constants.mod string_utilities.mod kinds.mod cp_output_handling.mod dct.mod input_cp2k_rsgrid.mod bibliography.mod base_hooks.mod pw_spline_utils.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewald_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/ewald_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cp_para_types.mod input_section_types.mod pw_poisson_types.mod input_enumeration_types.mod cp_log_handling.mod mathconstants.mod base_hooks.mod pw_grid_info.mod input_cp2k_poisson.mod cp_output_handling.mod cp_para_env.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewald_environment_types.F ewald_environment_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_environment_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewald_environment_types.mod' due to: ewald_environment_types.o /build/reproducible-path/cp2k-8.1/src/ewald_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cp_para_types.mod input_section_types.mod pw_poisson_types.mod input_enumeration_types.mod cp_log_handling.mod mathconstants.mod base_hooks.mod pw_grid_info.mod input_cp2k_poisson.mod cp_output_handling.mod cp_para_env.mod cp_units.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_realspace_grid_init.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_realspace_grid_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod realspace_grid_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_realspace_grid_init.F cp_realspace_grid_init.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_realspace_grid_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_realspace_grid_init.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_realspace_grid_init.mod' due to: cp_realspace_grid_init.o /build/reproducible-path/cp2k-8.1/src/cp_realspace_grid_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod realspace_grid_types.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_poisson_methods.mod' due to: pw_poisson_methods.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dgs.mod' due to: dgs.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_poisson_read_input.o' due to: /build/reproducible-path/cp2k-8.1/src/pw_poisson_read_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dirichlet_bc_types.mod ps_wavelet_types.mod pw_poisson_types.mod input_section_types.mod cell_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw_poisson_read_input.F pw_poisson_read_input.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:48:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_poisson_read_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_poisson_read_input.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_poisson_read_input.mod' due to: pw_poisson_read_input.o /build/reproducible-path/cp2k-8.1/src/pw_poisson_read_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dirichlet_bc_types.mod ps_wavelet_types.mod pw_poisson_types.mod input_section_types.mod cell_types.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:50:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_kind_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_kind_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_kind_types.mod' due to: qs_kind_types.o /build/reproducible-path/cp2k-8.1/src/qs_kind_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod semi_empirical_types.mod atom_types.mod qs_dispersion_types.mod xtb_types.mod qs_dftb_types.mod atomic_kind_types.mod basis_set_types.mod external_potential_types.mod input_section_types.mod cp_control_types.mod basis_set_container_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod qs_dftb_utils.mod periodic_table.mod atom_upf.mod qs_harmonics_atom.mod string_utilities.mod qs_grid_atom.mod semi_empirical_utils.mod xtb_parameters.mod orbital_pointers.mod base_hooks.mod mathconstants.mod atom_sgp.mod input_constants.mod soft_basis_set.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewald_pw_types.o' due to: /build/reproducible-path/cp2k-8.1/src/ewald_pw_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dg_types.mod realspace_grid_types.mod cell_types.mod cp_para_types.mod pw_poisson_types.mod pw_pool_types.mod input_section_types.mod ewald_environment_types.mod pw_grid_types.mod cp_realspace_grid_init.mod mathconstants.mod pw_grids.mod kinds.mod pw_poisson_methods.mod cp_output_handling.mod ao_util.mod message_passing.mod dgs.mod cp_log_handling.mod base_hooks.mod pw_poisson_read_input.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewald_pw_types.F ewald_pw_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:49:00 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_pw_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_pw_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewald_pw_types.mod' due to: ewald_pw_types.o /build/reproducible-path/cp2k-8.1/src/ewald_pw_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dg_types.mod realspace_grid_types.mod cell_types.mod cp_para_types.mod pw_poisson_types.mod pw_pool_types.mod input_section_types.mod ewald_environment_types.mod pw_grid_types.mod cp_realspace_grid_init.mod mathconstants.mod pw_grids.mod kinds.mod pw_poisson_methods.mod cp_output_handling.mod ao_util.mod message_passing.mod dgs.mod cp_log_handling.mod base_hooks.mod pw_poisson_read_input.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_efield_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_efield_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_efield_types.F fist_efield_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:49:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_efield_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_efield_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_efield_types.mod' due to: fist_efield_types.o /build/reproducible-path/cp2k-8.1/src/fist_efield_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_gaussian_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_types.F qmmm_gaussian_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:49:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gaussian_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gaussian_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_gaussian_types.mod' due to: qmmm_gaussian_types.o /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_field_types.o' due to: /build/reproducible-path/cp2k-8.1/src/force_field_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod shell_potential_types.mod damping_dipole_types.mod pair_potential_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/force_field_types.F force_field_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:49:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_field_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_field_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_field_types.mod' due to: force_field_types.o /build/reproducible-path/cp2k-8.1/src/force_field_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod shell_potential_types.mod damping_dipole_types.mod pair_potential_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'minimax_exp_k15.o' due to: /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_k15.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_k15.F minimax_exp_k15.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:51:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_exp_k15.F\"" -I'/build/reproducible-path/cp2k-8.1/src/minimax/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_exp_k15.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'minimax_exp_k15.mod' due to: minimax_exp_k15.o /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_k15.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'minimax_exp_k53.o' due to: /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_k53.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_k53.F minimax_exp_k53.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:49:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_exp_k53.F\"" -I'/build/reproducible-path/cp2k-8.1/src/minimax/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_exp_k53.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:51:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_exp_k53.F\"" -I'/build/reproducible-path/cp2k-8.1/src/minimax/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_exp_k53.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'minimax_exp_k53.mod' due to: minimax_exp_k53.o /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_k53.F kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'minimax_exp_k15.o' due to: /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_k15.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_k15.F minimax_exp_k15.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:49:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_exp_k15.F\"" -I'/build/reproducible-path/cp2k-8.1/src/minimax/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_exp_k15.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'minimax_exp_k15.mod' due to: minimax_exp_k15.o /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_k15.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'minimax_exp.o' due to: /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 minimax_exp_k53.mod base_hooks.mod cp_log_handling.mod minimax_exp_k15.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'minimax_exp.o' due to: /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 minimax_exp_k15.mod cp_log_handling.mod kinds.mod minimax_exp_k53.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp.F minimax_exp.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:49:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_exp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/minimax/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_exp.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'minimax_exp.mod' due to: minimax_exp.o /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 minimax_exp_k53.mod base_hooks.mod cp_log_handling.mod minimax_exp_k15.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:51:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_exp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/minimax/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_exp.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'minimax_exp.mod' due to: minimax_exp.o /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 minimax_exp_k15.mod cp_log_handling.mod kinds.mod minimax_exp_k53.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_gaussian.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_gaussian.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod minimax_exp.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_gaussian.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_gaussian.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 minimax_exp.mod base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_gaussian.F eri_mme_gaussian.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:49:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_gaussian.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_gaussian.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_gaussian.mod' due to: eri_mme_gaussian.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_gaussian.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod minimax_exp.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:51:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_gaussian.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_gaussian.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_gaussian.mod' due to: eri_mme_gaussian.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_gaussian.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 minimax_exp.mod base_hooks.mod mathconstants.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_lattice_summation.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_lattice_summation.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_unroll.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ao_util.mod base_hooks.mod mathconstants.mod eri_mme_gaussian.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_lattice_summation.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_lattice_summation.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_unroll.fypp mathconstants.mod ao_util.mod kinds.mod orbital_pointers.mod eri_mme_gaussian.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_lattice_summation.F eri_mme_lattice_summation.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:49:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_lattice_summation.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_lattice_summation.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_lattice_summation.mod' due to: eri_mme_lattice_summation.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_lattice_summation.F /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_unroll.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ao_util.mod base_hooks.mod mathconstants.mod eri_mme_gaussian.mod orbital_pointers.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:51:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_lattice_summation.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_lattice_summation.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_lattice_summation.mod' due to: eri_mme_lattice_summation.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_lattice_summation.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_unroll.fypp mathconstants.mod ao_util.mod kinds.mod orbital_pointers.mod eri_mme_gaussian.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_error_control.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_error_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod ao_util.mod base_hooks.mod mathconstants.mod message_passing.mod eri_mme_gaussian.mod eri_mme_lattice_summation.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_error_control.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_error_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod message_passing.mod mathconstants.mod ao_util.mod kinds.mod eri_mme_gaussian.mod eri_mme_lattice_summation.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_error_control.F eri_mme_error_control.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_error_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_error_control.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:58:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_error_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_error_control.F90 /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_error_control.F:357:40: 357 | zet_c = zet_b - gr*(zet_b - zet_a) | ^ Warning: 'zet_b' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_error_control.F:357:40: Warning: 'zet_a' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_error_control.mod' due to: eri_mme_error_control.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_error_control.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod ao_util.mod base_hooks.mod mathconstants.mod message_passing.mod eri_mme_gaussian.mod eri_mme_lattice_summation.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_error_control.mod' due to: eri_mme_error_control.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_error_control.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod message_passing.mod mathconstants.mod ao_util.mod kinds.mod eri_mme_gaussian.mod eri_mme_lattice_summation.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_util.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_util.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_util.F eri_mme_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_util.mod' due to: eri_mme_util.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:58:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_util.mod' due to: eri_mme_util.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_types.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mathlib.mod eri_mme_error_control.mod base_hooks.mod eri_mme_gaussian.mod eri_mme_util.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_types.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mathlib.mod kinds.mod orbital_pointers.mod eri_mme_gaussian.mod eri_mme_error_control.mod eri_mme_util.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_types.F eri_mme_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_types.mod' due to: eri_mme_types.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mathlib.mod eri_mme_error_control.mod base_hooks.mod eri_mme_gaussian.mod eri_mme_util.mod orbital_pointers.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:58:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_types.mod' due to: eri_mme_types.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mathlib.mod kinds.mod orbital_pointers.mod eri_mme_gaussian.mod eri_mme_error_control.mod eri_mme_util.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_integrate.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_integrate.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 eri_mme_types.mod ao_util.mod base_hooks.mod mathconstants.mod eri_mme_gaussian.mod orbital_pointers.mod eri_mme_lattice_summation.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_integrate.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_integrate.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 eri_mme_types.mod mathconstants.mod ao_util.mod kinds.mod orbital_pointers.mod eri_mme_gaussian.mod eri_mme_lattice_summation.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_integrate.F eri_mme_integrate.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_integrate.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_integrate.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:58:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_integrate.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_integrate.F90 /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_integrate.F:718:39: 718 | /vol*mone_lb @@ -4767,11 +4762,11 @@ | ^ Warning: 's_g.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_integrate.F:93:63: Warning: 's_g.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_integrate.mod' due to: eri_mme_integrate.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_integrate.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 eri_mme_types.mod ao_util.mod base_hooks.mod mathconstants.mod eri_mme_gaussian.mod orbital_pointers.mod eri_mme_lattice_summation.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_integrate.mod' due to: eri_mme_integrate.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_integrate.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 eri_mme_types.mod mathconstants.mod ao_util.mod kinds.mod orbital_pointers.mod eri_mme_gaussian.mod eri_mme_lattice_summation.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_test.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_test.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod eri_mme_types.mod base_hooks.mod mathconstants.mod message_passing.mod eri_mme_gaussian.mod orbital_pointers.mod eri_mme_integrate.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eri_mme_test.o' due to: /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_test.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod eri_mme_types.mod eri_mme_integrate.mod message_passing.mod mathconstants.mod kinds.mod orbital_pointers.mod eri_mme_gaussian.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_test.F eri_mme_test.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_test.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_test.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:58:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_test.F\"" -I'/build/reproducible-path/cp2k-8.1/src/eri_mme/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eri_mme_test.F90 /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_test.F:78:73: 78 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :, :) :: I_diff, I_ref, I_test @@ -4780,344 +4775,372 @@ /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_test.F:78:73: Warning: 'i_ref.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_test.F:78:73: Warning: 'i_ref.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_test.F:78:73: Warning: 'i_ref.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_test.mod' due to: eri_mme_test.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_test.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod eri_mme_types.mod base_hooks.mod mathconstants.mod message_passing.mod eri_mme_gaussian.mod orbital_pointers.mod eri_mme_integrate.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eri_mme_test.mod' due to: eri_mme_test.o /build/reproducible-path/cp2k-8.1/src/eri_mme/eri_mme_test.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod eri_mme_types.mod eri_mme_integrate.mod message_passing.mod mathconstants.mod kinds.mod orbital_pointers.mod eri_mme_gaussian.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_eri_mme_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_eri_mme_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod basis_set_types.mod input_keyword_types.mod cp_para_types.mod input_section_types.mod qs_kind_types.mod eri_mme_types.mod cell_types.mod string_utilities.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod orbital_pointers.mod kinds.mod eri_mme_test.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_eri_mme_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_eri_mme_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod basis_set_types.mod input_val_types.mod qs_kind_types.mod eri_mme_types.mod cell_types.mod input_section_types.mod input_keyword_types.mod eri_mme_test.mod message_passing.mod cp_log_handling.mod kinds.mod orbital_pointers.mod cp_output_handling.mod string_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_eri_mme_interface.F cp_eri_mme_interface.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_eri_mme_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_eri_mme_interface.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_eri_mme_interface.mod' due to: cp_eri_mme_interface.o /build/reproducible-path/cp2k-8.1/src/cp_eri_mme_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod basis_set_types.mod input_keyword_types.mod cp_para_types.mod input_section_types.mod qs_kind_types.mod eri_mme_types.mod cell_types.mod string_utilities.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod orbital_pointers.mod kinds.mod eri_mme_test.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_eri_mme_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_eri_mme_interface.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_eri_mme_interface.mod' due to: cp_eri_mme_interface.o /build/reproducible-path/cp2k-8.1/src/cp_eri_mme_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod basis_set_types.mod input_val_types.mod qs_kind_types.mod eri_mme_types.mod cell_types.mod input_section_types.mod input_keyword_types.mod eri_mme_test.mod message_passing.mod cp_log_handling.mod kinds.mod orbital_pointers.mod cp_output_handling.mod string_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_types_low.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_types_low.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qmmm_gaussian_types.mod ewald_pw_types.mod pw_types.mod pw_pool_types.mod force_field_types.mod ewald_environment_types.mod particle_types.mod input_constants.mod base_hooks.mod pw_grids.mod kinds.mod cp_eri_mme_interface.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_types_low.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_types_low.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ewald_pw_types.mod pw_grid_types.mod pw_pool_types.mod ewald_environment_types.mod pw_types.mod particle_types.mod qmmm_gaussian_types.mod force_field_types.mod cp_eri_mme_interface.mod kinds.mod pw_grids.mod input_constants.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_types_low.F qmmm_types_low.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_types_low.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_types_low.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_types_low.mod' due to: qmmm_types_low.o /build/reproducible-path/cp2k-8.1/src/qmmm_types_low.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod qmmm_gaussian_types.mod ewald_pw_types.mod pw_types.mod pw_pool_types.mod force_field_types.mod ewald_environment_types.mod particle_types.mod input_constants.mod base_hooks.mod pw_grids.mod kinds.mod cp_eri_mme_interface.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_types_low.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_types_low.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_types_low.mod' due to: qmmm_types_low.o /build/reproducible-path/cp2k-8.1/src/qmmm_types_low.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ewald_pw_types.mod pw_grid_types.mod pw_pool_types.mod ewald_environment_types.mod pw_types.mod particle_types.mod qmmm_gaussian_types.mod force_field_types.mod cp_eri_mme_interface.mod kinds.mod pw_grids.mod input_constants.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'exclusion_types.o' due to: /build/reproducible-path/cp2k-8.1/src/exclusion_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/exclusion_types.F exclusion_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"exclusion_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' exclusion_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'exclusion_types.mod' due to: exclusion_types.o /build/reproducible-path/cp2k-8.1/src/exclusion_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_neighbor_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_neighbor_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 exclusion_types.mod cell_types.mod kinds.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_neighbor_list_types.F fist_neighbor_list_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_neighbor_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_neighbor_list_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_neighbor_list_types.mod' due to: fist_neighbor_list_types.o /build/reproducible-path/cp2k-8.1/src/fist_neighbor_list_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 exclusion_types.mod cell_types.mod kinds.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod fist_energy_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod fist_nonbond_env_types.mod cp_subsys_types.mod exclusion_types.mod particle_list_types.mod distribution_1d_types.mod molecule_list_types.mod multipole_types.mod atomic_kind_types.mod ewald_pw_types.mod fist_efield_types.mod cp_result_types.mod input_section_types.mod qmmm_types_low.mod ewald_environment_types.mod molecule_types.mod cp_para_env.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_nonbond_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_nonbond_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod cell_types.mod fist_neighbor_list_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_nonbond_env_types.F fist_nonbond_env_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_nonbond_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_nonbond_env_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_nonbond_env_types.mod' due to: fist_nonbond_env_types.o /build/reproducible-path/cp2k-8.1/src/fist_nonbond_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod cell_types.mod fist_neighbor_list_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_energy_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_energy_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_energy_types.F fist_energy_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_energy_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_energy_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_energy_types.mod' due to: fist_energy_types.o /build/reproducible-path/cp2k-8.1/src/fist_energy_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod fist_efield_types.mod cp_subsys_types.mod qmmm_types_low.mod cp_result_types.mod particle_types.mod cell_types.mod molecule_types.mod exclusion_types.mod particle_list_types.mod fist_nonbond_env_types.mod molecule_kind_list_types.mod atomic_kind_types.mod ewald_environment_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod ewald_pw_types.mod molecule_list_types.mod atomic_kind_list_types.mod multipole_types.mod fist_energy_types.mod cp_para_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_environment_types.F fist_environment_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_environment_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_environment_types.mod' due to: fist_environment_types.o /build/reproducible-path/cp2k-8.1/src/fist_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod fist_energy_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod fist_nonbond_env_types.mod cp_subsys_types.mod exclusion_types.mod particle_list_types.mod distribution_1d_types.mod molecule_list_types.mod multipole_types.mod atomic_kind_types.mod ewald_pw_types.mod fist_efield_types.mod cp_result_types.mod input_section_types.mod qmmm_types_low.mod ewald_environment_types.mod molecule_types.mod cp_para_env.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_environment_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_environment_types.mod' due to: fist_environment_types.o /build/reproducible-path/cp2k-8.1/src/fist_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod fist_efield_types.mod cp_subsys_types.mod qmmm_types_low.mod cp_result_types.mod particle_types.mod cell_types.mod molecule_types.mod exclusion_types.mod particle_list_types.mod fist_nonbond_env_types.mod molecule_kind_list_types.mod atomic_kind_types.mod ewald_environment_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod ewald_pw_types.mod molecule_list_types.mod atomic_kind_list_types.mod multipole_types.mod fist_energy_types.mod cp_para_env.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_pool_types.mod' due to: cp_fm_pool_types.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eip_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/eip_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod molecule_types.mod particle_list_types.mod molecule_list_types.mod atomic_kind_list_types.mod cell_types.mod distribution_1d_types.mod particle_types.mod virial_types.mod input_section_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/eip_environment_types.F eip_environment_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eip_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eip_environment_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eip_environment_types.mod' due to: eip_environment_types.o /build/reproducible-path/cp2k-8.1/src/eip_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod molecule_types.mod particle_list_types.mod molecule_list_types.mod atomic_kind_list_types.mod cell_types.mod distribution_1d_types.mod particle_types.mod virial_types.mod input_section_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'nnp_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/nnp_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod molecule_types.mod particle_list_types.mod molecule_list_types.mod atomic_kind_list_types.mod cell_types.mod distribution_1d_types.mod particle_types.mod virial_types.mod input_section_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/nnp_environment_types.F nnp_environment_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_environment_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'nnp_environment_types.mod' due to: nnp_environment_types.o /build/reproducible-path/cp2k-8.1/src/nnp_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod molecule_types.mod particle_list_types.mod molecule_list_types.mod atomic_kind_list_types.mod cell_types.mod distribution_1d_types.mod particle_types.mod virial_types.mod input_section_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fp_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fp_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fp_types.F fp_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fp_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fp_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fp_types.mod' due to: fp_types.o /build/reproducible-path/cp2k-8.1/src/fp_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_force_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_force_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod atomic_kind_types.mod message_passing.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_force_types.F qs_force_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_force_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_force_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_force_types.mod' due to: qs_force_types.o /build/reproducible-path/cp2k-8.1/src/qs_force_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod atomic_kind_types.mod message_passing.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_energy_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_energy_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_energy_types.F qs_energy_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_energy_types.mod' due to: qs_energy_types.o /build/reproducible-path/cp2k-8.1/src/qs_energy_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_subsys_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_subsys_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cp_result_types.mod particle_types.mod cell_types.mod qs_force_types.mod colvar_types.mod atprop_types.mod molecule_types.mod particle_list_types.mod molecule_kind_list_types.mod atomic_kind_types.mod qs_kind_types.mod distribution_1d_types.mod molecule_kind_types.mod virial_types.mod molecule_list_types.mod qs_energy_types.mod atomic_kind_list_types.mod multipole_types.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_subsys_types.F qs_subsys_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:32 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_subsys_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_subsys_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_subsys_types.mod' due to: qs_subsys_types.o /build/reproducible-path/cp2k-8.1/src/qs_subsys_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cp_result_types.mod particle_types.mod cell_types.mod qs_force_types.mod colvar_types.mod atprop_types.mod molecule_types.mod particle_list_types.mod molecule_kind_list_types.mod atomic_kind_types.mod qs_kind_types.mod distribution_1d_types.mod molecule_kind_types.mod virial_types.mod molecule_list_types.mod qs_energy_types.mod atomic_kind_list_types.mod multipole_types.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'distribution_2d_types.o' due to: /build/reproducible-path/cp2k-8.1/src/distribution_2d_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_blacs_env.mod base_hooks.mod cp_log_handling.mod cp_array_utils.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pwdft_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pwdft_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod input_section_types.mod qs_subsys_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pwdft_environment_types.F pwdft_environment_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pwdft_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pwdft_environment_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pwdft_environment_types.mod' due to: pwdft_environment_types.o /build/reproducible-path/cp2k-8.1/src/pwdft_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod input_section_types.mod qs_subsys_types.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rel_control_types.o' due to: /build/reproducible-path/cp2k-8.1/src/rel_control_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rel_control_types.F rel_control_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rel_control_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rel_control_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rel_control_types.mod' due to: rel_control_types.o /build/reproducible-path/cp2k-8.1/src/rel_control_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_loc_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_loc_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod cp_fm_types.mod distribution_1d_types.mod cp_array_utils.mod kinds.mod base_hooks.mod cp_para_env.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_loc_types.F qs_loc_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:37 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_loc_types.mod' due to: qs_loc_types.o /build/reproducible-path/cp2k-8.1/src/qs_loc_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod cp_fm_types.mod distribution_1d_types.mod cp_array_utils.mod kinds.mod base_hooks.mod cp_para_env.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'distribution_2d_types.o' due to: /build/reproducible-path/cp2k-8.1/src/distribution_2d_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_log_handling.mod cp_array_utils.mod cp_blacs_env.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/distribution_2d_types.F distribution_2d_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"distribution_2d_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' distribution_2d_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'distribution_2d_types.mod' due to: distribution_2d_types.o /build/reproducible-path/cp2k-8.1/src/distribution_2d_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_blacs_env.mod base_hooks.mod cp_log_handling.mod cp_array_utils.mod machine.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"distribution_2d_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' distribution_2d_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'distribution_2d_types.mod' due to: distribution_2d_types.o /build/reproducible-path/cp2k-8.1/src/distribution_2d_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_log_handling.mod cp_array_utils.mod cp_blacs_env.mod machine.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_operations.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_operations.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod cp_fm_types.mod cp_para_types.mod cp_cfm_types.mod mathlib.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod cp_fm_basic_linalg.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_operations.F cp_dbcsr_operations.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_operations.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_operations.mod' due to: cp_dbcsr_operations.o /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_operations.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod cp_fm_types.mod cp_para_types.mod cp_cfm_types.mod mathlib.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tensors_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tensors_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod cp_para_types.mod basis_set_types.mod qs_neighbor_list_types.mod particle_types.mod atomic_kind_types.mod message_passing.mod cp_array_utils.mod base_hooks.mod cp_blacs_env.mod cp_para_env.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tensors_types.F qs_tensors_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tensors_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tensors_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tensors_types.mod' due to: qs_tensors_types.o /build/reproducible-path/cp2k-8.1/src/qs_tensors_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod cp_para_types.mod basis_set_types.mod qs_neighbor_list_types.mod particle_types.mod atomic_kind_types.mod message_passing.mod cp_array_utils.mod base_hooks.mod cp_blacs_env.mod cp_para_env.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mo_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mo_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_fm_types.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_mo_types.F qs_mo_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mo_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mo_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mo_types.mod' due to: qs_mo_types.o /build/reproducible-path/cp2k-8.1/src/qs_mo_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_fm_types.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_helpers.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_helpers.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_helpers.F hfx_helpers.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_helpers.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_helpers.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_helpers.mod' due to: hfx_helpers.o /build/reproducible-path/cp2k-8.1/src/hfx_helpers.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_active_space_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_active_space_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod cp_fm_types.mod base_hooks.mod message_passing.mod cp_dbcsr_operations.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_active_space_types.F qs_active_space_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_active_space_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_active_space_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_active_space_types.mod' due to: qs_active_space_types.o /build/reproducible-path/cp2k-8.1/src/qs_active_space_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod cp_fm_types.mod base_hooks.mod message_passing.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'aux_basis_set.mod' due to: aux_basis_set.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'transport_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/transport_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/transport_env_types.F transport_env_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"transport_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' transport_env_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'transport_env_types.mod' due to: transport_env_types.o /build/reproducible-path/cp2k-8.1/src/transport_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'auto_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/auto_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod mathconstants.mod kinds.mod orbital_pointers.mod aux_basis_set.mod powell.mod periodic_table.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/auto_basis.F auto_basis.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"auto_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' auto_basis.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'auto_basis.mod' due to: auto_basis.o /build/reproducible-path/cp2k-8.1/src/auto_basis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod mathconstants.mod kinds.mod orbital_pointers.mod aux_basis_set.mod powell.mod periodic_table.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kpoint_transitional.o' due to: /build/reproducible-path/cp2k-8.1/src/kpoint_transitional.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_dbcsr_operations.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kpoint_transitional.F kpoint_transitional.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_transitional.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_transitional.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kpoint_transitional.mod' due to: kpoint_transitional.o /build/reproducible-path/cp2k-8.1/src/kpoint_transitional.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_dbcsr_operations.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_interactions.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_interactions.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 paw_proj_set_types.mod basis_set_types.mod cp_control_types.mod external_potential_types.mod qs_kind_types.mod input_section_types.mod atomic_kind_types.mod cp_units.mod ao_util.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod string_utilities.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_interactions.F qs_interactions.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 14:59:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_interactions.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_interactions.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_interactions.mod' due to: qs_interactions.o /build/reproducible-path/cp2k-8.1/src/qs_interactions.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 paw_proj_set_types.mod basis_set_types.mod cp_control_types.mod external_potential_types.mod qs_kind_types.mod input_section_types.mod atomic_kind_types.mod cp_units.mod ao_util.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod string_utilities.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod kpoint_transitional.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho_types.F qs_rho_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho_types.mod' due to: qs_rho_types.o /build/reproducible-path/cp2k-8.1/src/qs_rho_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod kpoint_transitional.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'libint_wrapper.o' due to: /build/reproducible-path/cp2k-8.1/src/libint_wrapper.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod orbital_pointers.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/libint_wrapper.F libint_wrapper.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:00:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"libint_wrapper.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' libint_wrapper.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'libint_wrapper.mod' due to: libint_wrapper.o /build/reproducible-path/cp2k-8.1/src/libint_wrapper.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod orbital_pointers.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho_atom_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho_atom_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho_atom_types.F qs_rho_atom_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho_atom_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho_atom_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho_atom_types.mod' due to: qs_rho_atom_types.o /build/reproducible-path/cp2k-8.1/src/qs_rho_atom_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_integral_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_integral_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod basis_set_types.mod orbital_pointers.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_integral_utils.F qs_integral_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:00:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_integral_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_integral_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_integral_utils.mod' due to: qs_integral_utils.o /build/reproducible-path/cp2k-8.1/src/qs_integral_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod basis_set_types.mod orbital_pointers.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'whittaker.mod' due to: whittaker.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'libint_2c_3c.o' due to: /build/reproducible-path/cp2k-8.1/src/libint_2c_3c.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod libint_wrapper.mod kinds.mod orbital_pointers.mod input_constants.mod t_c_g0.mod gamma.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/libint_2c_3c.F libint_2c_3c.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:00:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"libint_2c_3c.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' libint_2c_3c.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'libint_2c_3c.mod' due to: libint_2c_3c.o /build/reproducible-path/cp2k-8.1/src/libint_2c_3c.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod libint_wrapper.mod kinds.mod orbital_pointers.mod input_constants.mod t_c_g0.mod gamma.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho0_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho0_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_rho_atom_types.mod base_hooks.mod mathconstants.mod whittaker.mod qs_grid_atom.mod cp_units.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho0_types.F qs_rho0_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho0_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho0_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho0_types.mod' due to: qs_rho0_types.o /build/reproducible-path/cp2k-8.1/src/qs_rho0_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_rho_atom_types.mod base_hooks.mod mathconstants.mod whittaker.mod qs_grid_atom.mod cp_units.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_ff_fist.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_ff_fist.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_ff_fist.F qmmm_ff_fist.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:00:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_ff_fist.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_ff_fist.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_ff_fist.mod' due to: qmmm_ff_fist.o /build/reproducible-path/cp2k-8.1/src/qmmm_ff_fist.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_local_rho_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_local_rho_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho0_types.mod qs_rho_atom_types.mod qs_harmonics_atom.mod base_hooks.mod mathconstants.mod qs_grid_atom.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_local_rho_types.F qs_local_rho_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_local_rho_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_local_rho_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_local_rho_types.mod' due to: qs_local_rho_types.o /build/reproducible-path/cp2k-8.1/src/qs_local_rho_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho0_types.mod qs_rho_atom_types.mod qs_harmonics_atom.mod base_hooks.mod mathconstants.mod qs_grid_atom.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'particle_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/particle_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod atomic_kind_types.mod basis_set_types.mod external_potential_types.mod qs_kind_types.mod input_section_types.mod shell_potential_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod qmmm_ff_fist.mod string_utilities.mod memory_utilities.mod mathlib.mod util.mod base_hooks.mod mathconstants.mod input_constants.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/particle_methods.F particle_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:00:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"particle_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' particle_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'particle_methods.mod' due to: particle_methods.o /build/reproducible-path/cp2k-8.1/src/particle_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod atomic_kind_types.mod basis_set_types.mod external_potential_types.mod qs_kind_types.mod input_section_types.mod shell_potential_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod qmmm_ff_fist.mod string_utilities.mod memory_utilities.mod mathlib.mod util.mod base_hooks.mod mathconstants.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_moments.mod' due to: ai_moments.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_field.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_field.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod string_utilities.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_field.F input_cp2k_field.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:00:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_field.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_field.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_field.mod' due to: input_cp2k_field.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_field.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod string_utilities.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'sap_kind_types.o' due to: /build/reproducible-path/cp2k-8.1/src/sap_kind_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod particle_types.mod external_potential_types.mod qs_neighbor_list_types.mod cell_types.mod ai_moments.mod ai_overlap.mod base_hooks.mod util.mod orbital_pointers.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/sap_kind_types.F sap_kind_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"sap_kind_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' sap_kind_types.F90 -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:76: - - 299 | REAL(KIND=dp), DIMENSION(:), POINTER :: a_nl, alpha_ppnl, hprj, set_radius_a - | ^ -Warning: 'alpha_ppnl.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:76: Warning: 'alpha_ppnl.span' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:76: Warning: 'alpha_ppnl.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:76: Warning: 'alpha_ppnl.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:288:92: - - 288 | INTEGER, DIMENSION(:), POINTER :: la_max, la_min, npgfa, nprj_ppnl, & - | ^ -Warning: 'nprj_ppnl.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:288:92: Warning: 'nprj_ppnl.span' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:288:92: Warning: 'nprj_ppnl.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:288:92: Warning: 'nprj_ppnl.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:300:96: - - 300 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, h_nl, rpgfa, sphi_a, vprj_ppnl, & - | ^ -Warning: 'vprj_ppnl.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:300:96: Warning: 'vprj_ppnl.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:300:96: Warning: 'vprj_ppnl.span' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:300:96: Warning: 'vprj_ppnl.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:300:96: Warning: 'vprj_ppnl.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:82: - - 299 | REAL(KIND=dp), DIMENSION(:), POINTER :: a_nl, alpha_ppnl, hprj, set_radius_a - | ^ -Warning: 'hprj.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:82: Warning: 'hprj.span' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:82: Warning: 'hprj.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:82: Warning: 'hprj.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:285:83: - - 285 | maxsgf, na, nb, ncoa, ncoc, nkind, nlist, nneighbor, nnl, np, nppnl, nprjc, nseta, nsgfa, & - | ^ -Warning: 'nprjc' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'sap_kind_types.mod' due to: sap_kind_types.o /build/reproducible-path/cp2k-8.1/src/sap_kind_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod particle_types.mod external_potential_types.mod qs_neighbor_list_types.mod cell_types.mod ai_moments.mod ai_overlap.mod base_hooks.mod util.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_mm.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_mm.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod force_field_kind_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_poisson.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod input_cp2k_field.mod bibliography.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_mm.F input_cp2k_mm.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:00:26 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_mm.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_mm.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_mm.mod' due to: input_cp2k_mm.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_mm.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod force_field_kind_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_poisson.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod input_cp2k_field.mod bibliography.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'block_p_types.o' due to: /build/reproducible-path/cp2k-8.1/src/block_p_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/block_p_types.F block_p_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"block_p_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' block_p_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'block_p_types.mod' due to: block_p_types.o /build/reproducible-path/cp2k-8.1/src/block_p_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_colvar.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_colvar.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod colvar_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_colvar.F input_cp2k_colvar.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:00:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_colvar.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_colvar.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_colvar.mod' due to: input_cp2k_colvar.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_colvar.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod colvar_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_oce_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_oce_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod block_p_types.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_oce_types.F qs_oce_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_oce_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_oce_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_oce_types.mod' due to: qs_oce_types.o /build/reproducible-path/cp2k-8.1/src/qs_oce_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod block_p_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_subsys.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_subsys.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod cell_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod physcon.mod cp_output_handling.mod string_utilities.mod input_cp2k_mm.mod input_cp2k_colvar.mod bibliography.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_subsys.F input_cp2k_subsys.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:00:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_subsys.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_subsys.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_subsys.mod' due to: input_cp2k_subsys.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_subsys.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod cell_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod physcon.mod cp_output_handling.mod string_utilities.mod input_cp2k_mm.mod input_cp2k_colvar.mod bibliography.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'grid_api.mod' due to: grid_api.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_motion_print.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_motion_print.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod input_constants.mod cp_output_handling.mod input_cp2k_subsys.mod string_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_motion_print.F input_cp2k_motion_print.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:00:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_motion_print.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_motion_print.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_motion_print.mod' due to: input_cp2k_motion_print.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_motion_print.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod input_constants.mod cp_output_handling.mod input_cp2k_subsys.mod string_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'task_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/task_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 grid_api.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/task_list_types.F task_list_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"task_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' task_list_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'task_list_types.mod' due to: task_list_types.o /build/reproducible-path/cp2k-8.1/src/task_list_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 grid_api.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_loc.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_loc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod input_cp2k_motion_print.mod bibliography.mod input_cp2k_mm.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_loc.F input_cp2k_loc.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:00:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_loc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_loc.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_loc.mod' due to: input_cp2k_loc.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_loc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod input_cp2k_motion_print.mod bibliography.mod input_cp2k_mm.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'admm_types.o' due to: /build/reproducible-path/cp2k-8.1/src/admm_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_oce_types.mod qs_mo_types.mod cp_para_types.mod input_section_types.mod qs_kind_types.mod cp_control_types.mod task_list_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod cp_fm_struct.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/admm_types.F admm_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:52:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'admm_types.mod' due to: admm_types.o /build/reproducible-path/cp2k-8.1/src/admm_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_oce_types.mod qs_mo_types.mod cp_para_types.mod input_section_types.mod qs_kind_types.mod cp_control_types.mod task_list_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod cp_fm_struct.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_hfx.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_hfx.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod input_cp2k_loc.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_hfx.F input_cp2k_hfx.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:00:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_hfx.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_hfx.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_hfx.mod' due to: input_cp2k_hfx.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_hfx.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod input_cp2k_loc.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mscfg_types.o' due to: /build/reproducible-path/cp2k-8.1/src/mscfg_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mscfg_types.F mscfg_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mscfg_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mscfg_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mscfg_types.mod' due to: mscfg_types.o /build/reproducible-path/cp2k-8.1/src/mscfg_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_types.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_loc_types.mod qs_tensors_types.mod atomic_kind_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod basis_set_container_types.mod cp_log_handling.mod kinds.mod hfx_helpers.mod cp_output_handling.mod auto_basis.mod qs_interactions.mod bibliography.mod message_passing.mod libint_wrapper.mod qs_integral_utils.mod string_utilities.mod t_c_g0.mod mathlib.mod libint_2c_3c.mod cp_files.mod orbital_pointers.mod particle_methods.mod input_cp2k_hfx.mod machine.mod base_hooks.mod input_constants.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_types.F hfx_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:00:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_types.mod' due to: hfx_types.o /build/reproducible-path/cp2k-8.1/src/hfx_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_loc_types.mod qs_tensors_types.mod atomic_kind_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod basis_set_container_types.mod cp_log_handling.mod kinds.mod hfx_helpers.mod cp_output_handling.mod auto_basis.mod qs_interactions.mod bibliography.mod message_passing.mod libint_wrapper.mod qs_integral_utils.mod string_utilities.mod t_c_g0.mod mathlib.mod libint_2c_3c.mod cp_files.mod orbital_pointers.mod particle_methods.mod input_cp2k_hfx.mod machine.mod base_hooks.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rel_control_types.o' due to: /build/reproducible-path/cp2k-8.1/src/rel_control_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rel_control_types.F rel_control_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rel_control_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rel_control_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rel_control_types.mod' due to: rel_control_types.o /build/reproducible-path/cp2k-8.1/src/rel_control_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_types.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod cp_fm_types.mod cp_eri_mme_interface.mod libint_2c_3c.mod kinds.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_types.F mp2_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:01:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_types.mod' due to: mp2_types.o /build/reproducible-path/cp2k-8.1/src/mp2_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod cp_fm_types.mod cp_eri_mme_interface.mod libint_2c_3c.mod kinds.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'et_coupling_types.o' due to: /build/reproducible-path/cp2k-8.1/src/et_coupling_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/et_coupling_types.F et_coupling_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"et_coupling_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' et_coupling_types.F90 -/build/reproducible-path/cp2k-8.1/src/et_coupling_types.F:74:34: - - 74 | SUBROUTINE get_et_coupling_type(et_coupling, et_mo_coeff, rest_mat) - | ^ -Warning: 'get_et_coupling_type' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'et_coupling_types.mod' due to: et_coupling_types.o /build/reproducible-path/cp2k-8.1/src/et_coupling_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_operations.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_operations.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod cp_para_types.mod cp_cfm_types.mod cp_fm_types.mod mathlib.mod kinds.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_fm_basic_linalg.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_operations.F cp_dbcsr_operations.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:01:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_operations.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_operations.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_operations.mod' due to: cp_dbcsr_operations.o /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_operations.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod cp_para_types.mod cp_cfm_types.mod cp_fm_types.mod mathlib.mod kinds.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_fm_basic_linalg.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hartree_local_types.o' due to: /build/reproducible-path/cp2k-8.1/src/hartree_local_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_atom_types.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hartree_local_types.F hartree_local_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hartree_local_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hartree_local_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hartree_local_types.mod' due to: hartree_local_types.o /build/reproducible-path/cp2k-8.1/src/hartree_local_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_atom_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kpoint_transitional.o' due to: /build/reproducible-path/cp2k-8.1/src/kpoint_transitional.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kpoint_transitional.F kpoint_transitional.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:01:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_transitional.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_transitional.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kpoint_transitional.mod' due to: kpoint_transitional.o /build/reproducible-path/cp2k-8.1/src/kpoint_transitional.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_kpoints.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_kpoints.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_kpoints.F input_cp2k_kpoints.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_kpoints.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_kpoints.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_kpoints.mod' due to: input_cp2k_kpoints.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_kpoints.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod kinds.mod base_hooks.mod kpoint_transitional.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho_types.F qs_rho_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:01:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho_types.mod' due to: qs_rho_types.o /build/reproducible-path/cp2k-8.1/src/qs_rho_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod kinds.mod base_hooks.mod kpoint_transitional.mod cp_dbcsr_operations.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_wf_history_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_wf_history_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_rho_types.mod cp_fm_types.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_wf_history_types.F qs_wf_history_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:01:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_wf_history_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_wf_history_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_wf_history_types.mod' due to: qs_wf_history_types.o /build/reproducible-path/cp2k-8.1/src/qs_wf_history_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_rho_types.mod cp_fm_types.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mscfg_types.o' due to: /build/reproducible-path/cp2k-8.1/src/mscfg_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mscfg_types.F mscfg_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:01:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mscfg_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mscfg_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mscfg_types.mod' due to: mscfg_types.o /build/reproducible-path/cp2k-8.1/src/mscfg_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_pool_types.mod' due to: cp_fm_pool_types.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mo_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mo_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_fm_types.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_mo_types.F qs_mo_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:01:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mo_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mo_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mo_types.mod' due to: qs_mo_types.o /build/reproducible-path/cp2k-8.1/src/qs_mo_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_fm_types.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_active_space_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_active_space_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod qs_mo_types.mod message_passing.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_active_space_types.F qs_active_space_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:01:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_active_space_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_active_space_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_active_space_types.mod' due to: qs_active_space_types.o /build/reproducible-path/cp2k-8.1/src/qs_active_space_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod qs_mo_types.mod message_passing.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_matrix_pools.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_matrix_pools.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_para_types.mod qs_mo_types.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_matrix_pools.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_matrix_pools.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_mo_types.mod cp_fm_pool_types.mod cp_blacs_env.mod cp_fm_struct.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_matrix_pools.F qs_matrix_pools.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_matrix_pools.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_matrix_pools.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_matrix_pools.mod' due to: qs_matrix_pools.o /build/reproducible-path/cp2k-8.1/src/qs_matrix_pools.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_para_types.mod qs_mo_types.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:01:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_matrix_pools.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_matrix_pools.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_matrix_pools.mod' due to: qs_matrix_pools.o /build/reproducible-path/cp2k-8.1/src/qs_matrix_pools.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_mo_types.mod cp_fm_pool_types.mod cp_blacs_env.mod cp_fm_struct.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_kpoints.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_kpoints.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod string_utilities.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_kpoints.F input_cp2k_kpoints.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_kpoints.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_kpoints.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_kpoints.mod' due to: input_cp2k_kpoints.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_kpoints.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod string_utilities.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kpoint_types.o' due to: /build/reproducible-path/cp2k-8.1/src/kpoint_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod qs_mo_types.mod qs_neighbor_list_types.mod cp_fm_types.mod string_utilities.mod cp_log_handling.mod mathconstants.mod base_hooks.mod input_cp2k_kpoints.mod qs_matrix_pools.mod cp_output_handling.mod cp_blacs_env.mod cp_para_env.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kpoint_types.o' due to: /build/reproducible-path/cp2k-8.1/src/kpoint_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod qs_neighbor_list_types.mod cp_fm_types.mod qs_mo_types.mod mathconstants.mod cp_log_handling.mod kinds.mod qs_matrix_pools.mod physcon.mod cp_output_handling.mod cp_blacs_env.mod string_utilities.mod cp_para_env.mod input_cp2k_kpoints.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kpoint_types.F kpoint_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_types.F90 /build/reproducible-path/cp2k-8.1/src/kpoint_types.F:418:29: 418 | SUBROUTINE set_kpoint_info(kpoint, kp_scheme, nkp_grid, kp_shift, symmetry, verbose, & | ^ Warning: 'set_kpoint_info' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kpoint_types.mod' due to: kpoint_types.o /build/reproducible-path/cp2k-8.1/src/kpoint_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod qs_mo_types.mod qs_neighbor_list_types.mod cp_fm_types.mod string_utilities.mod cp_log_handling.mod mathconstants.mod base_hooks.mod input_cp2k_kpoints.mod qs_matrix_pools.mod cp_output_handling.mod cp_blacs_env.mod cp_para_env.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_o3c_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_o3c_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_o3c_types.F qs_o3c_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_o3c_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_o3c_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_o3c_types.mod' due to: qs_o3c_types.o /build/reproducible-path/cp2k-8.1/src/qs_o3c_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_o3c_types.mod qs_neighbor_list_types.mod mathlib.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_environment_types.F lri_environment_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:16 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_environment_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_environment_types.mod' due to: lri_environment_types.o /build/reproducible-path/cp2k-8.1/src/lri_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_o3c_types.mod qs_neighbor_list_types.mod mathlib.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_period_efield_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_period_efield_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_dbcsr_operations.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_period_efield_types.F qs_period_efield_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_period_efield_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_period_efield_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_period_efield_types.mod' due to: qs_period_efield_types.o /build/reproducible-path/cp2k-8.1/src/qs_period_efield_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_dbcsr_operations.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'wannier_states_types.o' due to: /build/reproducible-path/cp2k-8.1/src/wannier_states_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/wannier_states_types.F wannier_states_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"wannier_states_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' wannier_states_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'wannier_states_types.mod' due to: wannier_states_types.o /build/reproducible-path/cp2k-8.1/src/wannier_states_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kpoint_types.mod' due to: kpoint_types.o /build/reproducible-path/cp2k-8.1/src/kpoint_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod qs_neighbor_list_types.mod cp_fm_types.mod qs_mo_types.mod mathconstants.mod cp_log_handling.mod kinds.mod qs_matrix_pools.mod physcon.mod cp_output_handling.mod cp_blacs_env.mod string_utilities.mod cp_para_env.mod input_cp2k_kpoints.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'admm_dm_types.o' due to: /build/reproducible-path/cp2k-8.1/src/admm_dm_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod input_constants.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'admm_dm_types.o' due to: /build/reproducible-path/cp2k-8.1/src/admm_dm_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod kinds.mod input_constants.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/admm_dm_types.F admm_dm_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_dm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_dm_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'admm_dm_types.mod' due to: admm_dm_types.o /build/reproducible-path/cp2k-8.1/src/admm_dm_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod input_constants.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pexsi_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/pexsi_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pexsi_interface.F pexsi_interface.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pexsi_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pexsi_interface.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pexsi_interface.mod' due to: pexsi_interface.o /build/reproducible-path/cp2k-8.1/src/pexsi_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pexsi_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pexsi_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_log_handling.mod message_passing.mod base_hooks.mod pexsi_interface.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pexsi_types.F pexsi_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pexsi_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pexsi_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pexsi_types.mod' due to: pexsi_types.o /build/reproducible-path/cp2k-8.1/src/pexsi_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_log_handling.mod message_passing.mod base_hooks.mod pexsi_interface.mod bibliography.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_dm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_dm_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'admm_dm_types.mod' due to: admm_dm_types.o /build/reproducible-path/cp2k-8.1/src/admm_dm_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod kinds.mod input_constants.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_density_mixing_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_density_mixing_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod qs_rho_atom_types.mod input_constants.mod ao_util.mod string_utilities.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_density_mixing_types.F qs_density_mixing_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_density_mixing_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_density_mixing_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_density_mixing_types.mod' due to: qs_density_mixing_types.o /build/reproducible-path/cp2k-8.1/src/qs_density_mixing_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod qs_rho_atom_types.mod input_constants.mod ao_util.mod string_utilities.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gaussian_gridlevels.o' due to: /build/reproducible-path/cp2k-8.1/src/pw_env/gaussian_gridlevels.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_output_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw_env/gaussian_gridlevels.F gaussian_gridlevels.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env/gaussian_gridlevels.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw_env/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gaussian_gridlevels.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'gaussian_gridlevels.mod' due to: gaussian_gridlevels.o /build/reproducible-path/cp2k-8.1/src/pw_env/gaussian_gridlevels.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_output_handling.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'linesearch.o' due to: /build/reproducible-path/cp2k-8.1/src/linesearch.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/linesearch.F linesearch.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"linesearch.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' linesearch.F90 -/build/reproducible-path/cp2k-8.1/src/linesearch.F:321:32: - - 321 | this%step_size = step_size - | ^ -Warning: 'step_size' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/linesearch.F:322:27: - - 322 | this%starts = is_done - | ^ -Warning: 'is_done' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'linesearch.mod' due to: linesearch.o /build/reproducible-path/cp2k-8.1/src/linesearch.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw_env/pw_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod pw_pool_types.mod input_section_types.mod realspace_grid_types.mod cube_utils.mod gaussian_gridlevels.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw_env/pw_env_types.F pw_env_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env/pw_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw_env/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_env_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_env_types.mod' due to: pw_env_types.o /build/reproducible-path/cp2k-8.1/src/pw_env/pw_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod pw_pool_types.mod input_section_types.mod realspace_grid_types.mod cube_utils.mod gaussian_gridlevels.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 linesearch.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_types.F pao_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_types.mod' due to: pao_types.o /build/reproducible-path/cp2k-8.1/src/pao_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 linesearch.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'grid_api.mod' due to: grid_api.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_types.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod pexsi_types.mod qs_density_mixing_types.mod pao_types.mod input_constants.mod base_hooks.mod cp_para_env.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_types.F dm_ls_scf_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_types.mod' due to: dm_ls_scf_types.o /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod pexsi_types.mod qs_density_mixing_types.mod pao_types.mod input_constants.mod base_hooks.mod cp_para_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'task_list_types.o' due to: /build/reproducible-path/cp2k-8.1/src/task_list_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod grid_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/task_list_types.F task_list_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"task_list_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' task_list_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'task_list_types.mod' due to: task_list_types.o /build/reproducible-path/cp2k-8.1/src/task_list_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod grid_api.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gaussian_gridlevels.o' due to: /build/reproducible-path/cp2k-8.1/src/pw_env/gaussian_gridlevels.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw_env/gaussian_gridlevels.F gaussian_gridlevels.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env/gaussian_gridlevels.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw_env/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gaussian_gridlevels.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'gaussian_gridlevels.mod' due to: gaussian_gridlevels.o /build/reproducible-path/cp2k-8.1/src/pw_env/gaussian_gridlevels.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod kpoint_types.mod admm_dm_types.mod cp_result_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod atprop_types.mod molecule_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod distribution_1d_types.mod qs_subsys_types.mod molecule_kind_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod task_list_types.mod kpoint_transitional.mod cp_dbcsr_operations.mod cp_para_env.mod cp_blacs_env.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ks_types.F qs_ks_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_types.mod' due to: qs_ks_types.o /build/reproducible-path/cp2k-8.1/src/qs_ks_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod kpoint_types.mod admm_dm_types.mod cp_result_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod atprop_types.mod molecule_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod distribution_1d_types.mod qs_subsys_types.mod molecule_kind_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod task_list_types.mod kpoint_transitional.mod cp_dbcsr_operations.mod cp_para_env.mod cp_blacs_env.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pw_env/pw_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_poisson_types.mod input_section_types.mod pw_pool_types.mod gaussian_gridlevels.mod base_hooks.mod cube_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw_env/pw_env_types.F pw_env_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env/pw_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw_env/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_env_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_env_types.mod' due to: pw_env_types.o /build/reproducible-path/cp2k-8.1/src/pw_env/pw_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_poisson_types.mod input_section_types.mod pw_pool_types.mod gaussian_gridlevels.mod base_hooks.mod cube_utils.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'preconditioner_types.o' due to: /build/reproducible-path/cp2k-8.1/src/preconditioner_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod kinds.mod base_hooks.mod input_constants.mod cp_blacs_env.mod cp_para_env.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/preconditioner_types.F preconditioner_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'preconditioner_types.mod' due to: preconditioner_types.o /build/reproducible-path/cp2k-8.1/src/preconditioner_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod kinds.mod base_hooks.mod input_constants.mod cp_blacs_env.mod cp_para_env.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_gcp_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_gcp_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_gcp_types.F qs_gcp_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gcp_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gcp_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_gcp_types.mod' due to: qs_gcp_types.o /build/reproducible-path/cp2k-8.1/src/qs_gcp_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ot_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ot_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod input_section_types.mod kinds.mod base_hooks.mod input_constants.mod cp_blacs_env.mod cp_para_env.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ot_types.F qs_ot_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ot_types.mod' due to: qs_ot_types.o /build/reproducible-path/cp2k-8.1/src/qs_ot_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod input_section_types.mod kinds.mod base_hooks.mod input_constants.mod cp_blacs_env.mod cp_para_env.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_colvar.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_colvar.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod colvar_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_colvar.F input_cp2k_colvar.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_colvar.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_colvar.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_colvar.mod' due to: input_cp2k_colvar.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_colvar.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod colvar_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho_atom_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho_atom_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho_atom_types.F qs_rho_atom_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho_atom_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho_atom_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho_atom_types.mod' due to: qs_rho_atom_types.o /build/reproducible-path/cp2k-8.1/src/qs_rho_atom_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_field.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_field.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_field.F input_cp2k_field.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_field.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_field.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_field.mod' due to: input_cp2k_field.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_field.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_density_mixing_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_density_mixing_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod qs_rho_atom_types.mod input_section_types.mod input_keyword_types.mod ao_util.mod kinds.mod base_hooks.mod input_constants.mod string_utilities.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_density_mixing_types.F qs_density_mixing_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_density_mixing_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_density_mixing_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_density_mixing_types.mod' due to: qs_density_mixing_types.o /build/reproducible-path/cp2k-8.1/src/qs_density_mixing_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod qs_rho_atom_types.mod input_section_types.mod input_keyword_types.mod ao_util.mod kinds.mod base_hooks.mod input_constants.mod string_utilities.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_mm.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_mm.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod force_field_kind_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod input_cp2k_poisson.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod input_cp2k_field.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_mm.F input_cp2k_mm.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_mm.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_mm.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_mm.mod' due to: input_cp2k_mm.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_mm.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod force_field_kind_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod input_cp2k_poisson.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod input_cp2k_field.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mom_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mom_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_constants.mod string_utilities.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_mom_types.F qs_mom_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mom_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mom_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mom_types.mod' due to: qs_mom_types.o /build/reproducible-path/cp2k-8.1/src/qs_mom_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_constants.mod string_utilities.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_subsys.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_subsys.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod cell_types.mod input_cp2k_colvar.mod input_constants.mod input_cp2k_mm.mod string_utilities.mod base_hooks.mod cp_output_handling.mod bibliography.mod physcon.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_subsys.F input_cp2k_subsys.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:51 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_subsys.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_subsys.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_subsys.mod' due to: input_cp2k_subsys.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_subsys.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod cell_types.mod input_cp2k_colvar.mod input_constants.mod input_cp2k_mm.mod string_utilities.mod base_hooks.mod cp_output_handling.mod bibliography.mod physcon.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_input_constants.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_input_constants.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_input_constants.F xc_input_constants.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_input_constants.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_input_constants.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_input_constants.mod' due to: xc_input_constants.o /build/reproducible-path/cp2k-8.1/src/xc/xc_input_constants.F true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cell_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/cell_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cp_para_types.mod input_section_types.mod cell_types.mod input_enumeration_types.mod cp_parser_types.mod input_constants.mod mathlib.mod cp_log_handling.mod mathconstants.mod base_hooks.mod cp_output_handling.mod input_cp2k_subsys.mod kinds.mod cp_units.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cell_methods.F cell_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cell_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cell_methods.mod' due to: cell_methods.o /build/reproducible-path/cp2k-8.1/src/cell_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cp_para_types.mod input_section_types.mod cell_types.mod input_enumeration_types.mod cp_parser_types.mod input_constants.mod mathlib.mod cp_log_handling.mod mathconstants.mod base_hooks.mod cp_output_handling.mod input_cp2k_subsys.mod kinds.mod cp_units.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_mp2.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_mp2.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod cp_eri_mme_interface.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod input_cp2k_hfx.mod bibliography.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_mp2.F input_cp2k_mp2.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_mp2.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_mp2.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_mp2.mod' due to: input_cp2k_mp2.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_mp2.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod cp_eri_mme_interface.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod input_cp2k_hfx.mod bibliography.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewald_spline_util.o' due to: /build/reproducible-path/cp2k-8.1/src/ewald_spline_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_grid_types.mod pw_methods.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod pw_grids.mod pw_spline_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewald_spline_util.F ewald_spline_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:53:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_spline_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_spline_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewald_spline_util.mod' due to: ewald_spline_util.o /build/reproducible-path/cp2k-8.1/src/ewald_spline_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod pw_pool_types.mod pw_types.mod cell_types.mod pw_grid_types.mod pw_methods.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod pw_grids.mod pw_spline_utils.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_xc.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_xc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod cp_output_handling.mod xc_input_constants.mod input_cp2k_mp2.mod string_utilities.mod input_cp2k_hfx.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_xc.F input_cp2k_xc.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_xc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_xc.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_xc.mod' due to: input_cp2k_xc.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_xc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod cp_output_handling.mod xc_input_constants.mod input_cp2k_mp2.mod string_utilities.mod input_cp2k_hfx.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_ddapc_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_ddapc_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod pw_types.mod cell_types.mod particle_types.mod input_constants.mod mathlib.mod cp_log_handling.mod mathconstants.mod message_passing.mod spherical_harmonics.mod base_hooks.mod pw_spline_utils.mod kinds.mod kahan_sum.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_ddapc_methods.F cp_ddapc_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_ddapc_methods.mod' due to: cp_ddapc_methods.o /build/reproducible-path/cp2k-8.1/src/cp_ddapc_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod pw_types.mod cell_types.mod particle_types.mod input_constants.mod mathlib.mod cp_log_handling.mod mathconstants.mod message_passing.mod spherical_harmonics.mod base_hooks.mod pw_spline_utils.mod kinds.mod kahan_sum.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_distribution.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_distribution.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod input_constants.mod string_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_distribution.F input_cp2k_distribution.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_distribution.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_distribution.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_distribution.mod' due to: input_cp2k_distribution.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_distribution.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod input_constants.mod string_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_ddapc_types.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_ddapc_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_poisson_types.mod input_section_types.mod pw_pool_types.mod pw_types.mod cell_types.mod particle_types.mod pw_grid_types.mod cell_methods.mod cp_log_handling.mod mathconstants.mod base_hooks.mod cp_output_handling.mod pw_grids.mod ewald_spline_util.mod cp_ddapc_methods.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_ddapc_types.F cp_ddapc_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_ddapc_types.mod' due to: cp_ddapc_types.o /build/reproducible-path/cp2k-8.1/src/cp_ddapc_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_poisson_types.mod input_section_types.mod pw_pool_types.mod pw_types.mod cell_types.mod particle_types.mod pw_grid_types.mod cell_methods.mod cp_log_handling.mod mathconstants.mod base_hooks.mod cp_output_handling.mod pw_grids.mod ewald_spline_util.mod cp_ddapc_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_ec.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_ec.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_xc.mod kinds.mod input_constants.mod string_utilities.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_ec.F input_cp2k_ec.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_ec.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_ec.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_ec.mod' due to: input_cp2k_ec.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_ec.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_xc.mod kinds.mod input_constants.mod string_utilities.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_vect.mod' due to: cp_fm_vect.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_spline_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/pw_env/cp_spline_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_types.mod input_section_types.mod kinds.mod pw_methods.mod pw_spline_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw_env/cp_spline_utils.F cp_spline_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env/cp_spline_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw_env/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_spline_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_spline_utils.mod' due to: cp_spline_utils.o /build/reproducible-path/cp2k-8.1/src/pw_env/cp_spline_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod pw_types.mod input_section_types.mod kinds.mod pw_methods.mod pw_spline_utils.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagation_types.o' due to: /build/reproducible-path/cp2k-8.1/src/rt_propagation_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_mo_types.mod cp_control_types.mod cp_fm_types.mod cp_fm_vect.mod cp_log_handling.mod base_hooks.mod qs_matrix_pools.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rt_propagation_types.F rt_propagation_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rt_propagation_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagation_types.mod' due to: rt_propagation_types.o /build/reproducible-path/cp2k-8.1/src/rt_propagation_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_mo_types.mod cp_control_types.mod cp_fm_types.mod cp_fm_vect.mod cp_log_handling.mod base_hooks.mod qs_matrix_pools.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_tb.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_tb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod string_utilities.mod bibliography.mod input_cp2k_mm.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_tb.F input_cp2k_tb.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:02:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_tb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_tb.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_tb.mod' due to: input_cp2k_tb.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_tb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod string_utilities.mod bibliography.mod input_cp2k_mm.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_loc_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_loc_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod cp_fm_types.mod base_hooks.mod cp_para_env.mod kinds.mod cp_array_utils.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_loc_types.F qs_loc_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_loc_types.mod' due to: qs_loc_types.o /build/reproducible-path/cp2k-8.1/src/qs_loc_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod cp_fm_types.mod base_hooks.mod cp_para_env.mod kinds.mod cp_array_utils.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_input.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod bibliography.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_input.F qs_fb_input.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:03:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_input.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_input.mod' due to: qs_fb_input.o /build/reproducible-path/cp2k-8.1/src/qs_fb_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod bibliography.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'preconditioner_types.o' due to: /build/reproducible-path/cp2k-8.1/src/preconditioner_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod cp_blacs_env.mod cp_para_env.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/preconditioner_types.F preconditioner_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'preconditioner_types.mod' due to: preconditioner_types.o /build/reproducible-path/cp2k-8.1/src/preconditioner_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod cp_blacs_env.mod cp_para_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_external.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_external.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod string_utilities.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_external.F input_cp2k_external.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:03:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_external.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_external.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_external.mod' due to: input_cp2k_external.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_external.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod string_utilities.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ot_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ot_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod preconditioner_types.mod input_constants.mod base_hooks.mod cp_fm_struct.mod bibliography.mod cp_blacs_env.mod cp_dbcsr_operations.mod cp_para_env.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ot_types.F qs_ot_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ot_types.mod' due to: qs_ot_types.o /build/reproducible-path/cp2k-8.1/src/qs_ot_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod preconditioner_types.mod input_constants.mod base_hooks.mod cp_fm_struct.mod bibliography.mod cp_blacs_env.mod cp_dbcsr_operations.mod cp_para_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_almo.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_almo.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_almo.F input_cp2k_almo.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:03:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_almo.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_almo.F90 +/build/reproducible-path/cp2k-8.1/src/input_cp2k_almo.F:684:55: + + 684 | optimizer_type .EQ. optimizer_lin_eq_pcg .OR. & + | ^ +Warning: 'optimizer_type' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_almo.mod' due to: input_cp2k_almo.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_almo.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mom_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mom_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_mom_types.F qs_mom_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mom_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mom_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mom_types.mod' due to: qs_mom_types.o /build/reproducible-path/cp2k-8.1/src/qs_mom_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'linesearch.o' due to: /build/reproducible-path/cp2k-8.1/src/linesearch.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod string_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/linesearch.F linesearch.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:03:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"linesearch.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' linesearch.F90 +/build/reproducible-path/cp2k-8.1/src/linesearch.F:321:32: + + 321 | this%step_size = step_size + | ^ +Warning: 'step_size' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/linesearch.F:322:27: + + 322 | this%starts = is_done + | ^ +Warning: 'is_done' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'linesearch.mod' due to: linesearch.o /build/reproducible-path/cp2k-8.1/src/linesearch.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod string_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_transport.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_transport.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_transport.F input_cp2k_transport.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_transport.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_transport.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_transport.mod' due to: input_cp2k_transport.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_transport.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 linesearch.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_types.F pao_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:03:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_types.mod' due to: pao_types.o /build/reproducible-path/cp2k-8.1/src/pao_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 linesearch.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_input.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod pao_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod bibliography.mod cp_output_handling.mod linesearch.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_input.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod pao_types.mod input_section_types.mod input_keyword_types.mod cp_log_handling.mod kinds.mod linesearch.mod cp_output_handling.mod string_utilities.mod bibliography.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_input.F pao_input.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_input.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:03:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_input.F90 /build/reproducible-path/cp2k-8.1/src/pao_input.F:232:31: 232 | s = "GAUSSIAN_PROCESS" @@ -5128,101 +5151,138 @@ 234 | s = "NEURAL_NETWORK" | 1 Warning: CHARACTER expression will be truncated in assignment (10/14) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_input.mod' due to: pao_input.o /build/reproducible-path/cp2k-8.1/src/pao_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod pao_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod bibliography.mod cp_output_handling.mod linesearch.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_input.mod' due to: pao_input.o /build/reproducible-path/cp2k-8.1/src/pao_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod pao_types.mod input_section_types.mod input_keyword_types.mod cp_log_handling.mod kinds.mod linesearch.mod cp_output_handling.mod string_utilities.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_ls.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_ls.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod qs_density_mixing_types.mod input_constants.mod string_utilities.mod base_hooks.mod pao_input.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_ls.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_ls.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod qs_density_mixing_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod pao_input.mod string_utilities.mod bibliography.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_ls.F input_cp2k_ls.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_ls.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_ls.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_ls.mod' due to: input_cp2k_ls.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_ls.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod qs_density_mixing_types.mod input_constants.mod string_utilities.mod base_hooks.mod pao_input.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:03:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_ls.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_ls.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_ls.mod' due to: input_cp2k_ls.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_ls.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod qs_density_mixing_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod pao_input.mod string_utilities.mod bibliography.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_motion_print.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_motion_print.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod input_cp2k_subsys.mod cp_output_handling.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_motion_print.F input_cp2k_motion_print.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:32 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_motion_print.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_motion_print.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_motion_print.mod' due to: input_cp2k_motion_print.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_motion_print.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod input_cp2k_subsys.mod cp_output_handling.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_transport.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_transport.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_transport.F input_cp2k_transport.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:03:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_transport.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_transport.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_transport.mod' due to: input_cp2k_transport.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_transport.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_spline_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/pw_env/cp_spline_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pw_types.mod pw_pool_types.mod pw_methods.mod base_hooks.mod pw_spline_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw_env/cp_spline_utils.F cp_spline_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env/cp_spline_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw_env/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_spline_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_spline_utils.mod' due to: cp_spline_utils.o /build/reproducible-path/cp2k-8.1/src/pw_env/cp_spline_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pw_types.mod pw_pool_types.mod pw_methods.mod base_hooks.mod pw_spline_utils.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_dft.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_dft.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod basis_set_types.mod input_val_types.mod input_section_types.mod qs_density_mixing_types.mod qs_mom_types.mod input_cp2k_xc.mod kinds.mod pw_grids.mod cp_output_handling.mod input_cp2k_distribution.mod bibliography.mod input_cp2k_ec.mod input_cp2k_rsgrid.mod cp_spline_utils.mod string_utilities.mod input_cp2k_tb.mod input_cp2k_kpoints.mod input_cp2k_poisson.mod qs_fb_input.mod input_cp2k_external.mod input_cp2k_field.mod input_cp2k_almo.mod input_cp2k_ls.mod input_cp2k_mm.mod base_hooks.mod input_cp2k_transport.mod input_constants.mod input_cp2k_motion_print.mod pw_spline_utils.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_dft.F input_cp2k_dft.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:03:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_dft.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_dft.F90 +/build/reproducible-path/cp2k-8.1/src/input_cp2k_dft.F:6455:34: + + 6455 | SUBROUTINE create_rigpw_section(section) + | ^ +Warning: 'create_rigpw_section' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_dft.mod' due to: input_cp2k_dft.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_dft.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod basis_set_types.mod input_val_types.mod input_section_types.mod qs_density_mixing_types.mod qs_mom_types.mod input_cp2k_xc.mod kinds.mod pw_grids.mod cp_output_handling.mod input_cp2k_distribution.mod bibliography.mod input_cp2k_ec.mod input_cp2k_rsgrid.mod cp_spline_utils.mod string_utilities.mod input_cp2k_tb.mod input_cp2k_kpoints.mod input_cp2k_poisson.mod qs_fb_input.mod input_cp2k_external.mod input_cp2k_field.mod input_cp2k_almo.mod input_cp2k_ls.mod input_cp2k_mm.mod base_hooks.mod input_cp2k_transport.mod input_constants.mod input_cp2k_motion_print.mod pw_spline_utils.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_distribution.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_distribution.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_distribution.F input_cp2k_distribution.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_distribution.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_distribution.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_distribution.mod' due to: input_cp2k_distribution.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_distribution.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'scf_control_types.o' due to: /build/reproducible-path/cp2k-8.1/src/scf_control_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_cdft_opt_types.mod qs_ot_types.mod outer_scf_control_types.mod input_enumeration_types.mod input_section_types.mod input_keyword_types.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod input_cp2k_dft.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/scf_control_types.F scf_control_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"scf_control_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' scf_control_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'scf_control_types.mod' due to: scf_control_types.o /build/reproducible-path/cp2k-8.1/src/scf_control_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_cdft_opt_types.mod qs_ot_types.mod outer_scf_control_types.mod input_enumeration_types.mod input_section_types.mod input_keyword_types.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod input_cp2k_dft.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_input_constants.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_input_constants.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_input_constants.F xc_input_constants.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_input_constants.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_input_constants.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_input_constants.mod' due to: xc_input_constants.o /build/reproducible-path/cp2k-8.1/src/xc/xc_input_constants.F +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_charges_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_charges_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_charges_types.F qs_charges_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_charges_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_charges_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_charges_types.mod' due to: qs_charges_types.o /build/reproducible-path/cp2k-8.1/src/qs_charges_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_loc.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_loc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod input_cp2k_motion_print.mod input_cp2k_mm.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_loc.F input_cp2k_loc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_loc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_loc.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_loc.mod' due to: input_cp2k_loc.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_loc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod input_cp2k_motion_print.mod input_cp2k_mm.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_moments.mod' due to: ai_moments.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_hfx.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_hfx.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_loc.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_hfx.F input_cp2k_hfx.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_hfx.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_hfx.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_hfx.mod' due to: input_cp2k_hfx.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_hfx.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_loc.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'sap_kind_types.o' due to: /build/reproducible-path/cp2k-8.1/src/sap_kind_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod external_potential_types.mod qs_kind_types.mod particle_types.mod cell_types.mod ai_moments.mod util.mod kinds.mod orbital_pointers.mod ai_overlap.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/sap_kind_types.F sap_kind_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"sap_kind_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' sap_kind_types.F90 +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:76: + + 299 | REAL(KIND=dp), DIMENSION(:), POINTER :: a_nl, alpha_ppnl, hprj, set_radius_a + | ^ +Warning: 'alpha_ppnl.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:76: Warning: 'alpha_ppnl.span' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:76: Warning: 'alpha_ppnl.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:76: Warning: 'alpha_ppnl.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:288:92: + + 288 | INTEGER, DIMENSION(:), POINTER :: la_max, la_min, npgfa, nprj_ppnl, & + | ^ +Warning: 'nprj_ppnl.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:288:92: Warning: 'nprj_ppnl.span' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:288:92: Warning: 'nprj_ppnl.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:288:92: Warning: 'nprj_ppnl.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:300:96: + + 300 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cprj, h_nl, rpgfa, sphi_a, vprj_ppnl, & + | ^ +Warning: 'vprj_ppnl.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:300:96: Warning: 'vprj_ppnl.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:300:96: Warning: 'vprj_ppnl.span' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:300:96: Warning: 'vprj_ppnl.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:300:96: Warning: 'vprj_ppnl.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:82: + + 299 | REAL(KIND=dp), DIMENSION(:), POINTER :: a_nl, alpha_ppnl, hprj, set_radius_a + | ^ +Warning: 'hprj.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:82: Warning: 'hprj.span' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:82: Warning: 'hprj.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:299:82: Warning: 'hprj.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/sap_kind_types.F:285:83: + + 285 | maxsgf, na, nb, ncoa, ncoc, nkind, nlist, nneighbor, nnl, np, nppnl, nprjc, nseta, nsgfa, & + | ^ +Warning: 'nprjc' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'sap_kind_types.mod' due to: sap_kind_types.o /build/reproducible-path/cp2k-8.1/src/sap_kind_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod external_potential_types.mod qs_kind_types.mod particle_types.mod cell_types.mod ai_moments.mod util.mod kinds.mod orbital_pointers.mod ai_overlap.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_mp2.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_mp2.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod input_cp2k_hfx.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod cp_eri_mme_interface.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_mp2.F input_cp2k_mp2.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_mp2.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_mp2.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_mp2.mod' due to: input_cp2k_mp2.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_mp2.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod input_cp2k_hfx.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod cp_eri_mme_interface.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'block_p_types.o' due to: /build/reproducible-path/cp2k-8.1/src/block_p_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/block_p_types.F block_p_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"block_p_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' block_p_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'block_p_types.mod' due to: block_p_types.o /build/reproducible-path/cp2k-8.1/src/block_p_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_xc.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_xc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod xc_input_constants.mod input_cp2k_hfx.mod bibliography.mod cp_output_handling.mod input_cp2k_mp2.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_xc.F input_cp2k_xc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_xc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_xc.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_xc.mod' due to: input_cp2k_xc.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_xc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod xc_input_constants.mod input_cp2k_hfx.mod bibliography.mod cp_output_handling.mod input_cp2k_mp2.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_oce_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_oce_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod block_p_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_oce_types.F qs_oce_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_oce_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_oce_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_oce_types.mod' due to: qs_oce_types.o /build/reproducible-path/cp2k-8.1/src/qs_oce_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 sap_kind_types.mod block_p_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_input.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod bibliography.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_input.F qs_fb_input.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_input.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_input.mod' due to: qs_fb_input.o /build/reproducible-path/cp2k-8.1/src/qs_fb_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod bibliography.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'whittaker.mod' due to: whittaker.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_external.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_external.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_external.F input_cp2k_external.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_external.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_external.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_external.mod' due to: input_cp2k_external.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_external.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho0_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho0_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_rho_atom_types.mod mathconstants.mod whittaker.mod kinds.mod base_hooks.mod qs_grid_atom.mod memory_utilities.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho0_types.F qs_rho0_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho0_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho0_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho0_types.mod' due to: qs_rho0_types.o /build/reproducible-path/cp2k-8.1/src/qs_rho0_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_rho_atom_types.mod mathconstants.mod whittaker.mod kinds.mod base_hooks.mod qs_grid_atom.mod memory_utilities.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_tb.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_tb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod input_cp2k_mm.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_tb.F input_cp2k_tb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_tb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_tb.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_tb.mod' due to: input_cp2k_tb.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_tb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod input_cp2k_mm.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_local_rho_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_local_rho_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho0_types.mod qs_rho_atom_types.mod qs_harmonics_atom.mod mathconstants.mod kinds.mod qs_grid_atom.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_local_rho_types.F qs_local_rho_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_local_rho_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_local_rho_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_local_rho_types.mod' due to: qs_local_rho_types.o /build/reproducible-path/cp2k-8.1/src/qs_local_rho_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho0_types.mod qs_rho_atom_types.mod qs_harmonics_atom.mod mathconstants.mod kinds.mod qs_grid_atom.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_ec.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_ec.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_xc.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_ec.F input_cp2k_ec.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:54:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_ec.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_ec.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_ec.mod' due to: input_cp2k_ec.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_ec.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_xc.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'admm_types.o' due to: /build/reproducible-path/cp2k-8.1/src/admm_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_mo_types.mod task_list_types.mod cp_control_types.mod qs_kind_types.mod qs_oce_types.mod cp_fm_types.mod input_section_types.mod qs_local_rho_types.mod kinds.mod input_constants.mod cp_fm_struct.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/admm_types.F admm_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'admm_types.mod' due to: admm_types.o /build/reproducible-path/cp2k-8.1/src/admm_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_mo_types.mod task_list_types.mod cp_control_types.mod qs_kind_types.mod qs_oce_types.mod cp_fm_types.mod input_section_types.mod qs_local_rho_types.mod kinds.mod input_constants.mod cp_fm_struct.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_almo.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_almo.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_almo.F input_cp2k_almo.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:55:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_almo.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_almo.F90 -/build/reproducible-path/cp2k-8.1/src/input_cp2k_almo.F:684:55: - - 684 | optimizer_type .EQ. optimizer_lin_eq_pcg .OR. & - | ^ -Warning: 'optimizer_type' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_almo.mod' due to: input_cp2k_almo.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_almo.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'domain_submatrix_types.o' due to: /build/reproducible-path/cp2k-8.1/src/domain_submatrix_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/domain_submatrix_types.F domain_submatrix_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:29 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"domain_submatrix_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' domain_submatrix_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'domain_submatrix_types.mod' due to: domain_submatrix_types.o /build/reproducible-path/cp2k-8.1/src/domain_submatrix_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_dft.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_dft.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod basis_set_types.mod qs_density_mixing_types.mod qs_mom_types.mod input_section_types.mod input_constants.mod string_utilities.mod input_cp2k_transport.mod pw_grids.mod input_cp2k_ls.mod kinds.mod input_cp2k_mm.mod input_cp2k_motion_print.mod cp_output_handling.mod cp_spline_utils.mod input_cp2k_distribution.mod input_cp2k_xc.mod qs_fb_input.mod input_cp2k_poisson.mod input_cp2k_rsgrid.mod bibliography.mod base_hooks.mod input_cp2k_external.mod input_cp2k_kpoints.mod input_cp2k_tb.mod pw_spline_utils.mod input_cp2k_ec.mod input_cp2k_almo.mod cp_units.mod input_cp2k_field.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_dft.F input_cp2k_dft.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:55:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_dft.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_dft.F90 -/build/reproducible-path/cp2k-8.1/src/input_cp2k_dft.F:6455:34: - - 6455 | SUBROUTINE create_rigpw_section(section) - | ^ -Warning: 'create_rigpw_section' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_dft.mod' due to: input_cp2k_dft.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_dft.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod basis_set_types.mod qs_density_mixing_types.mod qs_mom_types.mod input_section_types.mod input_constants.mod string_utilities.mod input_cp2k_transport.mod pw_grids.mod input_cp2k_ls.mod kinds.mod input_cp2k_mm.mod input_cp2k_motion_print.mod cp_output_handling.mod cp_spline_utils.mod input_cp2k_distribution.mod input_cp2k_xc.mod qs_fb_input.mod input_cp2k_poisson.mod input_cp2k_rsgrid.mod bibliography.mod base_hooks.mod input_cp2k_external.mod input_cp2k_kpoints.mod input_cp2k_tb.mod pw_spline_utils.mod input_cp2k_ec.mod input_cp2k_almo.mod cp_units.mod input_cp2k_field.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_types.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod domain_submatrix_types.mod kinds.mod base_hooks.mod input_constants.mod cp_blacs_env.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/almo_scf_types.F almo_scf_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_types.mod' due to: almo_scf_types.o /build/reproducible-path/cp2k-8.1/src/almo_scf_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod domain_submatrix_types.mod kinds.mod base_hooks.mod input_constants.mod cp_blacs_env.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'scf_control_types.o' due to: /build/reproducible-path/cp2k-8.1/src/scf_control_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod qs_cdft_opt_types.mod input_section_types.mod outer_scf_control_types.mod input_enumeration_types.mod qs_ot_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod input_cp2k_dft.mod cp_output_handling.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/scf_control_types.F scf_control_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:55:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"scf_control_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' scf_control_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'scf_control_types.mod' due to: scf_control_types.o /build/reproducible-path/cp2k-8.1/src/scf_control_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod qs_cdft_opt_types.mod input_section_types.mod outer_scf_control_types.mod input_enumeration_types.mod qs_ot_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod input_cp2k_dft.mod cp_output_handling.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_block_davidson_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_block_davidson_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod input_section_types.mod kinds.mod cp_fm_struct.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_block_davidson_types.F qs_block_davidson_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_block_davidson_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_block_davidson_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_block_davidson_types.mod' due to: qs_block_davidson_types.o /build/reproducible-path/cp2k-8.1/src/qs_block_davidson_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod input_section_types.mod kinds.mod cp_fm_struct.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_diis_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_diis_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_diis_types.F qs_diis_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_diis_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_diis_types.F90 +/build/reproducible-path/cp2k-8.1/src/qs_diis_types.F:84:30: + + 84 | SUBROUTINE qs_diis_b_retain(diis_buffer) + | ^ +Warning: 'qs_diis_b_retain' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_diis_types.mod' due to: qs_diis_types.o /build/reproducible-path/cp2k-8.1/src/qs_diis_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_atomic_halo_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_atomic_halo_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod input_section_types.mod qs_kind_types.mod cell_types.mod particle_types.mod string_utilities.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod util.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_atomic_halo_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_atomic_halo_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_kind_types.mod particle_types.mod cell_types.mod input_section_types.mod atomic_kind_types.mod message_passing.mod util.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod string_utilities.mod memory_utilities.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_atomic_halo_types.F qs_fb_atomic_halo_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:55:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_atomic_halo_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_atomic_halo_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_atomic_halo_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_atomic_halo_types.F90 /build/reproducible-path/cp2k-8.1/src/qs_fb_atomic_halo_types.F:140:35: 140 | SUBROUTINE fb_atomic_halo_retain(atomic_halo) @@ -5243,11 +5303,11 @@ 745 | SUBROUTINE fb_atomic_halo_list_write(atomic_halos, para_env, fb_section) | ^ Warning: 'fb_atomic_halo_list_write' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_atomic_halo_types.mod' due to: qs_fb_atomic_halo_types.o /build/reproducible-path/cp2k-8.1/src/qs_fb_atomic_halo_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod input_section_types.mod qs_kind_types.mod cell_types.mod particle_types.mod string_utilities.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod util.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_atomic_halo_types.mod' due to: qs_fb_atomic_halo_types.o /build/reproducible-path/cp2k-8.1/src/qs_fb_atomic_halo_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_kind_types.mod particle_types.mod cell_types.mod input_section_types.mod atomic_kind_types.mod message_passing.mod util.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod string_utilities.mod memory_utilities.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_trial_fns_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_trial_fns_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_trial_fns_types.F qs_fb_trial_fns_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:55:51 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_trial_fns_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_trial_fns_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_trial_fns_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_trial_fns_types.F90 /build/reproducible-path/cp2k-8.1/src/qs_fb_trial_fns_types.F:166:31: 166 | SUBROUTINE fb_trial_fns_init(trial_fns) @@ -5255,9 +5315,9 @@ Warning: 'fb_trial_fns_init' defined but not used [-Wunused-function] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_trial_fns_types.mod' due to: qs_fb_trial_fns_types.o /build/reproducible-path/cp2k-8.1/src/qs_fb_trial_fns_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_atomic_halo_types.mod qs_fb_trial_fns_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_atomic_halo_types.mod qs_fb_trial_fns_types.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_env_types.F qs_fb_env_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:55:51 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_env_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_env_types.F90 /build/reproducible-path/cp2k-8.1/src/qs_fb_env_types.F:101:27: 101 | SUBROUTINE fb_env_retain(fb_env) @@ -5273,158 +5333,173 @@ 213 | SUBROUTINE fb_env_init(fb_env) | ^ Warning: 'fb_env_init' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_env_types.mod' due to: qs_fb_env_types.o /build/reproducible-path/cp2k-8.1/src/qs_fb_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_atomic_halo_types.mod qs_fb_trial_fns_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_env_types.mod' due to: qs_fb_env_types.o /build/reproducible-path/cp2k-8.1/src/qs_fb_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_atomic_halo_types.mod qs_fb_trial_fns_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_block_davidson_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_block_davidson_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_fm_types.mod base_hooks.mod cp_fm_struct.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_block_davidson_types.F qs_block_davidson_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:55:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_block_davidson_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_block_davidson_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_block_davidson_types.mod' due to: qs_block_davidson_types.o /build/reproducible-path/cp2k-8.1/src/qs_block_davidson_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_fm_types.mod base_hooks.mod cp_fm_struct.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_diis_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_diis_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_diis_types.F qs_diis_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:55:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_diis_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_diis_types.F90 -/build/reproducible-path/cp2k-8.1/src/qs_diis_types.F:84:30: - - 84 | SUBROUTINE qs_diis_b_retain(diis_buffer) - | ^ -Warning: 'qs_diis_b_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_diis_types.mod' due to: qs_diis_types.o /build/reproducible-path/cp2k-8.1/src/qs_diis_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_vect.mod' due to: cp_fm_vect.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_env_types.mod input_section_types.mod qs_block_davidson_types.mod outer_scf_control_types.mod preconditioner_types.mod qs_density_mixing_types.mod qs_diis_types.mod qs_ot_types.mod cp_fm_types.mod cp_fm_vect.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_block_davidson_types.mod qs_diis_types.mod qs_density_mixing_types.mod preconditioner_types.mod qs_fb_env_types.mod qs_ot_types.mod outer_scf_control_types.mod cp_fm_types.mod input_section_types.mod kinds.mod cp_fm_vect.mod base_hooks.mod cp_dbcsr_operations.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_types.F qs_scf_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:55:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_types.mod' due to: qs_scf_types.o /build/reproducible-path/cp2k-8.1/src/qs_scf_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_env_types.mod input_section_types.mod qs_block_davidson_types.mod outer_scf_control_types.mod preconditioner_types.mod qs_density_mixing_types.mod qs_diis_types.mod qs_ot_types.mod cp_fm_types.mod cp_fm_vect.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_types.mod' due to: qs_scf_types.o /build/reproducible-path/cp2k-8.1/src/qs_scf_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_block_davidson_types.mod qs_diis_types.mod qs_density_mixing_types.mod preconditioner_types.mod qs_fb_env_types.mod qs_ot_types.mod outer_scf_control_types.mod cp_fm_types.mod input_section_types.mod kinds.mod cp_fm_vect.mod base_hooks.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_loc_types.mod scf_control_types.mod cp_fm_pool_types.mod qs_scf_types.mod cp_fm_types.mod base_hooks.mod cp_array_utils.mod cp_dbcsr_operations.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_env_types.F xas_env_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:55:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_env_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_env_types.mod' due to: xas_env_types.o /build/reproducible-path/cp2k-8.1/src/xas_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_loc_types.mod scf_control_types.mod cp_fm_pool_types.mod qs_scf_types.mod cp_fm_types.mod base_hooks.mod cp_array_utils.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'integration_grid_types.o' due to: /build/reproducible-path/cp2k-8.1/src/integration_grid_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/integration_grid_types.F integration_grid_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"integration_grid_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' integration_grid_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'integration_grid_types.mod' due to: integration_grid_types.o /build/reproducible-path/cp2k-8.1/src/integration_grid_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_loc_types.mod atomic_kind_types.mod qs_rho_types.mod realspace_grid_types.mod qs_kind_types.mod qs_rho_atom_types.mod cp_fm_types.mod qs_harmonics_atom.mod base_hooks.mod cp_array_utils.mod qs_grid_atom.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_types.F qs_linres_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_types.F90 -/build/reproducible-path/cp2k-8.1/src/qs_linres_types.F:1096:35: - - 1096 | SUBROUTINE deallocate_jrho_coeff(jrho1_atom_set, iatom) - | ^ -Warning: 'deallocate_jrho_coeff' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/qs_linres_types.F:1135:27: - - 1135 | SUBROUTINE get_jrho_atom(jrho1_atom_set, iatom, cjc_h, cjc_s, cjc_ii_h, cjc_ii_s, & - | ^ -Warning: 'get_jrho_atom' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_types.mod' due to: qs_linres_types.o /build/reproducible-path/cp2k-8.1/src/qs_linres_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_loc_types.mod atomic_kind_types.mod qs_rho_types.mod realspace_grid_types.mod qs_kind_types.mod qs_rho_atom_types.mod cp_fm_types.mod qs_harmonics_atom.mod base_hooks.mod cp_array_utils.mod qs_grid_atom.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_o3c_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_o3c_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_o3c_types.F qs_o3c_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_o3c_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_o3c_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_o3c_types.mod' due to: qs_o3c_types.o /build/reproducible-path/cp2k-8.1/src/qs_o3c_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_qmmm_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_qmmm_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_pool_types.mod pw_env_types.mod base_hooks.mod cp_dbcsr_operations.mod cube_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ks_qmmm_types.F qs_ks_qmmm_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_qmmm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_qmmm_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_qmmm_types.mod' due to: qs_ks_qmmm_types.o /build/reproducible-path/cp2k-8.1/src/qs_ks_qmmm_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_pool_types.mod pw_env_types.mod base_hooks.mod cp_dbcsr_operations.mod cube_utils.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_o3c_types.mod basis_set_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod mathlib.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_environment_types.F lri_environment_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:04:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_environment_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_environment_types.mod' due to: lri_environment_types.o /build/reproducible-path/cp2k-8.1/src/lri_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_o3c_types.mod basis_set_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod mathlib.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'domain_submatrix_types.o' due to: /build/reproducible-path/cp2k-8.1/src/domain_submatrix_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/domain_submatrix_types.F domain_submatrix_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"domain_submatrix_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' domain_submatrix_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'domain_submatrix_types.mod' due to: domain_submatrix_types.o /build/reproducible-path/cp2k-8.1/src/domain_submatrix_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kg_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/kg_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 integration_grid_types.mod qs_neighbor_list_types.mod molecule_types.mod task_list_types.mod lri_environment_types.mod qs_dispersion_types.mod input_section_types.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod qs_grid_atom.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kg_environment_types.F kg_environment_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:05:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_environment_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kg_environment_types.mod' due to: kg_environment_types.o /build/reproducible-path/cp2k-8.1/src/kg_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 integration_grid_types.mod qs_neighbor_list_types.mod molecule_types.mod task_list_types.mod lri_environment_types.mod qs_dispersion_types.mod input_section_types.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod qs_grid_atom.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_types.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod domain_submatrix_types.mod input_constants.mod base_hooks.mod cp_blacs_env.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/almo_scf_types.F almo_scf_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_types.mod' due to: almo_scf_types.o /build/reproducible-path/cp2k-8.1/src/almo_scf_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod domain_submatrix_types.mod input_constants.mod base_hooks.mod cp_blacs_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod basis_set_types.mod qs_loc_types.mod scf_control_types.mod cp_fm_pool_types.mod cp_fm_types.mod cp_array_utils.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_env_types.F xas_env_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:05:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_env_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_env_types.mod' due to: xas_env_types.o /build/reproducible-path/cp2k-8.1/src/xas_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod basis_set_types.mod qs_loc_types.mod scf_control_types.mod cp_fm_pool_types.mod cp_fm_types.mod cp_array_utils.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'integration_grid_types.o' due to: /build/reproducible-path/cp2k-8.1/src/integration_grid_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/integration_grid_types.F integration_grid_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"integration_grid_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' integration_grid_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'integration_grid_types.mod' due to: integration_grid_types.o /build/reproducible-path/cp2k-8.1/src/integration_grid_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pexsi_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/pexsi_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pexsi_interface.F pexsi_interface.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:05:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pexsi_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pexsi_interface.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pexsi_interface.mod' due to: pexsi_interface.o /build/reproducible-path/cp2k-8.1/src/pexsi_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kg_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/kg_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod molecule_types.mod input_section_types.mod qs_neighbor_list_types.mod integration_grid_types.mod task_list_types.mod qs_dispersion_types.mod base_hooks.mod cp_dbcsr_operations.mod qs_grid_atom.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kg_environment_types.F kg_environment_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_environment_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kg_environment_types.mod' due to: kg_environment_types.o /build/reproducible-path/cp2k-8.1/src/kg_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod molecule_types.mod input_section_types.mod qs_neighbor_list_types.mod integration_grid_types.mod task_list_types.mod qs_dispersion_types.mod base_hooks.mod cp_dbcsr_operations.mod qs_grid_atom.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pexsi_types.o' due to: /build/reproducible-path/cp2k-8.1/src/pexsi_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod pexsi_interface.mod bibliography.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pexsi_types.F pexsi_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:05:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pexsi_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pexsi_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pexsi_types.mod' due to: pexsi_types.o /build/reproducible-path/cp2k-8.1/src/pexsi_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod pexsi_interface.mod bibliography.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tensors_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tensors_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod basis_set_types.mod atomic_kind_types.mod cp_para_types.mod qs_neighbor_list_types.mod particle_types.mod cp_blacs_env.mod message_passing.mod base_hooks.mod cp_array_utils.mod cp_para_env.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tensors_types.F qs_tensors_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tensors_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tensors_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tensors_types.mod' due to: qs_tensors_types.o /build/reproducible-path/cp2k-8.1/src/qs_tensors_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod basis_set_types.mod atomic_kind_types.mod cp_para_types.mod qs_neighbor_list_types.mod particle_types.mod cp_blacs_env.mod message_passing.mod base_hooks.mod cp_array_utils.mod cp_para_env.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_types.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pexsi_types.mod qs_density_mixing_types.mod pao_types.mod input_section_types.mod kinds.mod base_hooks.mod input_constants.mod cp_para_env.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_types.F dm_ls_scf_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:05:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_types.mod' due to: dm_ls_scf_types.o /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pexsi_types.mod qs_density_mixing_types.mod pao_types.mod input_section_types.mod kinds.mod base_hooks.mod input_constants.mod cp_para_env.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'libint_wrapper.o' due to: /build/reproducible-path/cp2k-8.1/src/libint_wrapper.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod orbital_pointers.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/libint_wrapper.F libint_wrapper.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"libint_wrapper.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' libint_wrapper.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'libint_wrapper.mod' due to: libint_wrapper.o /build/reproducible-path/cp2k-8.1/src/libint_wrapper.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_compression_core_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_compression_core_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_compression_core_methods.F hfx_compression_core_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:05:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfxbase/hfx_compression_core_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/hfxbase/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_compression_core_methods.F90 +/build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_compression_core_methods.F:67:23: + + 67 | SUBROUTINE ints2ints(Ndata, packed_data, full_data) + | ^ +Warning: 'ints2ints' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_compression_core_methods.mod' due to: hfx_compression_core_methods.o /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_compression_core_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'libint_2c_3c.o' due to: /build/reproducible-path/cp2k-8.1/src/libint_2c_3c.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_constants.mod gamma.mod t_c_g0.mod base_hooks.mod mathconstants.mod libint_wrapper.mod orbital_pointers.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/libint_2c_3c.F libint_2c_3c.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"libint_2c_3c.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' libint_2c_3c.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'libint_2c_3c.mod' due to: libint_2c_3c.o /build/reproducible-path/cp2k-8.1/src/libint_2c_3c.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_constants.mod gamma.mod t_c_g0.mod base_hooks.mod mathconstants.mod libint_wrapper.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_compression_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_compression_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod kinds.mod cp_files.mod hfx_compression_core_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_compression_methods.F hfx_compression_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:06:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_compression_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_compression_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_compression_methods.mod' due to: hfx_compression_methods.o /build/reproducible-path/cp2k-8.1/src/hfx_compression_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod kinds.mod cp_files.mod hfx_compression_core_methods.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_helpers.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_helpers.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_helpers.F hfx_helpers.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_helpers.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_helpers.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_helpers.mod' due to: hfx_helpers.o /build/reproducible-path/cp2k-8.1/src/hfx_helpers.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_store_int_types.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_store_int_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod input_section_types.mod kinds.mod hfx_compression_methods.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_store_int_types.F semi_empirical_store_int_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:06:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_store_int_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_store_int_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_store_int_types.mod' due to: semi_empirical_store_int_types.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_store_int_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod input_section_types.mod kinds.mod hfx_compression_methods.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_interactions.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_interactions.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod input_section_types.mod qs_kind_types.mod external_potential_types.mod paw_proj_set_types.mod cp_control_types.mod string_utilities.mod ao_util.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_interactions.F qs_interactions.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_interactions.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_interactions.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_interactions.mod' due to: qs_interactions.o /build/reproducible-path/cp2k-8.1/src/qs_interactions.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod input_section_types.mod qs_kind_types.mod external_potential_types.mod paw_proj_set_types.mod cp_control_types.mod string_utilities.mod ao_util.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'transport_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/transport_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/transport_env_types.F transport_env_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:06:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"transport_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' transport_env_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'transport_env_types.mod' due to: transport_env_types.o /build/reproducible-path/cp2k-8.1/src/transport_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_integral_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_integral_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod orbital_pointers.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_integral_utils.F qs_integral_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_integral_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_integral_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_integral_utils.mod' due to: qs_integral_utils.o /build/reproducible-path/cp2k-8.1/src/qs_integral_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod orbital_pointers.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagation_types.o' due to: /build/reproducible-path/cp2k-8.1/src/rt_propagation_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod cp_control_types.mod cp_fm_pool_types.mod cp_fm_types.mod cp_log_handling.mod qs_matrix_pools.mod kinds.mod cp_fm_vect.mod base_hooks.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rt_propagation_types.F rt_propagation_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:06:56 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rt_propagation_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagation_types.mod' due to: rt_propagation_types.o /build/reproducible-path/cp2k-8.1/src/rt_propagation_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod cp_control_types.mod cp_fm_pool_types.mod cp_fm_types.mod cp_log_handling.mod qs_matrix_pools.mod kinds.mod cp_fm_vect.mod base_hooks.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'aux_basis_set.mod' due to: aux_basis_set.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewald_spline_util.o' due to: /build/reproducible-path/cp2k-8.1/src/ewald_spline_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_grid_types.mod pw_pool_types.mod pw_types.mod cell_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod kinds.mod pw_grids.mod pw_methods.mod cp_output_handling.mod pw_spline_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewald_spline_util.F ewald_spline_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:06:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_spline_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_spline_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewald_spline_util.mod' due to: ewald_spline_util.o /build/reproducible-path/cp2k-8.1/src/ewald_spline_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_grid_types.mod pw_pool_types.mod pw_types.mod cell_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod kinds.mod pw_grids.mod pw_methods.mod cp_output_handling.mod pw_spline_utils.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'auto_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/auto_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod periodic_table.mod base_hooks.mod mathconstants.mod powell.mod bibliography.mod aux_basis_set.mod orbital_pointers.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/auto_basis.F auto_basis.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"auto_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' auto_basis.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'auto_basis.mod' due to: auto_basis.o /build/reproducible-path/cp2k-8.1/src/auto_basis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod periodic_table.mod base_hooks.mod mathconstants.mod powell.mod bibliography.mod aux_basis_set.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cell_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/cell_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod cp_parser_types.mod input_enumeration_types.mod input_section_types.mod input_keyword_types.mod mathlib.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod input_cp2k_subsys.mod cp_parser_methods.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cell_methods.F cell_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cell_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cell_methods.mod' due to: cell_methods.o /build/reproducible-path/cp2k-8.1/src/cell_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod cp_parser_types.mod input_enumeration_types.mod input_section_types.mod input_keyword_types.mod mathlib.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod input_cp2k_subsys.mod cp_parser_methods.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_ff_fist.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_ff_fist.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_ff_fist.F qmmm_ff_fist.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_ff_fist.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_ff_fist.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_ff_fist.mod' due to: qmmm_ff_fist.o /build/reproducible-path/cp2k-8.1/src/qmmm_ff_fist.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_ddapc_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_ddapc_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_types.mod particle_types.mod cell_types.mod input_section_types.mod mathlib.mod message_passing.mod kahan_sum.mod cp_log_handling.mod mathconstants.mod kinds.mod input_constants.mod spherical_harmonics.mod pw_spline_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_ddapc_methods.F cp_ddapc_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_ddapc_methods.mod' due to: cp_ddapc_methods.o /build/reproducible-path/cp2k-8.1/src/cp_ddapc_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_types.mod particle_types.mod cell_types.mod input_section_types.mod mathlib.mod message_passing.mod kahan_sum.mod cp_log_handling.mod mathconstants.mod kinds.mod input_constants.mod spherical_harmonics.mod pw_spline_utils.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'particle_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/particle_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod particle_types.mod external_potential_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod string_utilities.mod mathconstants.mod util.mod kinds.mod qmmm_ff_fist.mod cp_output_handling.mod physcon.mod memory_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/particle_methods.F particle_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:56:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"particle_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' particle_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'particle_methods.mod' due to: particle_methods.o /build/reproducible-path/cp2k-8.1/src/particle_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod particle_types.mod external_potential_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod string_utilities.mod mathconstants.mod util.mod kinds.mod qmmm_ff_fist.mod cp_output_handling.mod physcon.mod memory_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_ddapc_types.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_ddapc_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod cp_para_types.mod input_section_types.mod pw_grid_types.mod pw_pool_types.mod pw_types.mod particle_types.mod cell_types.mod ewald_spline_util.mod mathconstants.mod cp_log_handling.mod kinds.mod pw_grids.mod cell_methods.mod cp_output_handling.mod cp_ddapc_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_ddapc_types.F cp_ddapc_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_ddapc_types.mod' due to: cp_ddapc_types.o /build/reproducible-path/cp2k-8.1/src/cp_ddapc_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod cp_para_types.mod input_section_types.mod pw_grid_types.mod pw_pool_types.mod pw_types.mod particle_types.mod cell_types.mod ewald_spline_util.mod mathconstants.mod cp_log_handling.mod kinds.mod pw_grids.mod cell_methods.mod cp_output_handling.mod cp_ddapc_methods.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_types.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_tensors_types.mod cp_control_types.mod particle_types.mod basis_set_container_types.mod qs_loc_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod string_utilities.mod libint_2c_3c.mod cp_files.mod hfx_helpers.mod kinds.mod t_c_g0.mod qs_interactions.mod cp_output_handling.mod qs_integral_utils.mod message_passing.mod auto_basis.mod input_cp2k_hfx.mod libint_wrapper.mod bibliography.mod particle_methods.mod mathlib.mod cp_log_handling.mod base_hooks.mod machine.mod orbital_pointers.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_types.F hfx_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:57:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_types.mod' due to: hfx_types.o /build/reproducible-path/cp2k-8.1/src/hfx_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_tensors_types.mod cp_control_types.mod particle_types.mod basis_set_container_types.mod qs_loc_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod string_utilities.mod libint_2c_3c.mod cp_files.mod hfx_helpers.mod kinds.mod t_c_g0.mod qs_interactions.mod cp_output_handling.mod qs_integral_utils.mod message_passing.mod auto_basis.mod input_cp2k_hfx.mod libint_wrapper.mod bibliography.mod particle_methods.mod mathlib.mod cp_log_handling.mod base_hooks.mod machine.mod orbital_pointers.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hartree_local_types.o' due to: /build/reproducible-path/cp2k-8.1/src/hartree_local_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_atom_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hartree_local_types.F hartree_local_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hartree_local_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hartree_local_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hartree_local_types.mod' due to: hartree_local_types.o /build/reproducible-path/cp2k-8.1/src/hartree_local_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_atom_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_rho_cflags_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_rho_cflags_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_rho_cflags_types.F xc_rho_cflags_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:57:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_rho_cflags_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_rho_cflags_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_rho_cflags_types.mod' due to: xc_rho_cflags_types.o /build/reproducible-path/cp2k-8.1/src/xc/xc_rho_cflags_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_period_efield_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_period_efield_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_period_efield_types.F qs_period_efield_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_period_efield_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_period_efield_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_period_efield_types.mod' due to: qs_period_efield_types.o /build/reproducible-path/cp2k-8.1/src/qs_period_efield_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_rho_set_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_rho_set_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod pw_types.mod pw_pool_types.mod pw_methods.mod base_hooks.mod xc_input_constants.mod pw_spline_utils.mod cp_array_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_rho_set_types.F xc_rho_set_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:57:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_rho_set_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_rho_set_types.F90 -/build/reproducible-path/cp2k-8.1/src/xc/xc_rho_set_types.F:163:31: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'wannier_states_types.o' due to: /build/reproducible-path/cp2k-8.1/src/wannier_states_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/wannier_states_types.F wannier_states_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"wannier_states_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' wannier_states_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'wannier_states_types.mod' due to: wannier_states_types.o /build/reproducible-path/cp2k-8.1/src/wannier_states_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_loc_types.mod qs_kind_types.mod qs_rho_atom_types.mod atomic_kind_types.mod qs_rho_types.mod cp_fm_types.mod realspace_grid_types.mod qs_harmonics_atom.mod cp_array_utils.mod kinds.mod base_hooks.mod qs_grid_atom.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_types.F qs_linres_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_types.F90 +/build/reproducible-path/cp2k-8.1/src/qs_linres_types.F:1096:35: - 163 | SUBROUTINE xc_rho_set_retain(rho_set) - | ^ -Warning: 'xc_rho_set_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_rho_set_types.mod' due to: xc_rho_set_types.o /build/reproducible-path/cp2k-8.1/src/xc/xc_rho_set_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod pw_types.mod pw_pool_types.mod pw_methods.mod base_hooks.mod xc_input_constants.mod pw_spline_utils.mod cp_array_utils.mod kinds.mod + 1096 | SUBROUTINE deallocate_jrho_coeff(jrho1_atom_set, iatom) + | ^ +Warning: 'deallocate_jrho_coeff' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/qs_linres_types.F:1135:27: + + 1135 | SUBROUTINE get_jrho_atom(jrho1_atom_set, iatom, cjc_h, cjc_s, cjc_ii_h, cjc_ii_s, & + | ^ +Warning: 'get_jrho_atom' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_types.mod' due to: qs_linres_types.o /build/reproducible-path/cp2k-8.1/src/qs_linres_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_loc_types.mod qs_kind_types.mod qs_rho_atom_types.mod atomic_kind_types.mod qs_rho_types.mod cp_fm_types.mod realspace_grid_types.mod qs_harmonics_atom.mod cp_array_utils.mod kinds.mod base_hooks.mod qs_grid_atom.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_gcp_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_gcp_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_gcp_types.F qs_gcp_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gcp_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gcp_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_gcp_types.mod' due to: qs_gcp_types.o /build/reproducible-path/cp2k-8.1/src/qs_gcp_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'et_coupling_types.o' due to: /build/reproducible-path/cp2k-8.1/src/et_coupling_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/et_coupling_types.F et_coupling_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"et_coupling_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' et_coupling_types.F90 +/build/reproducible-path/cp2k-8.1/src/et_coupling_types.F:74:34: + + 74 | SUBROUTINE get_et_coupling_type(et_coupling, et_mo_coeff, rest_mat) + | ^ +Warning: 'get_et_coupling_type' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'et_coupling_types.mod' due to: et_coupling_types.o /build/reproducible-path/cp2k-8.1/src/et_coupling_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_qmmm_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_qmmm_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_env_types.mod pw_pool_types.mod pw_types.mod cube_utils.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ks_qmmm_types.F qs_ks_qmmm_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_qmmm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_qmmm_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_qmmm_types.mod' due to: qs_ks_qmmm_types.o /build/reproducible-path/cp2k-8.1/src/qs_ks_qmmm_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_env_types.mod pw_pool_types.mod pw_types.mod cube_utils.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_derivative_desc.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_desc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_desc.F xc_derivative_desc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:57:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_derivative_desc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_derivative_desc.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_derivative_desc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_derivative_desc.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_derivative_desc.mod' due to: xc_derivative_desc.o /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_desc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_derivative_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod base_hooks.mod kinds.mod xc_derivative_desc.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_derivative_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod base_hooks.mod xc_derivative_desc.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_types.F xc_derivative_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:57:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_derivative_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_derivative_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_derivative_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_derivative_types.F90 /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_types.F:92:34: 92 | SUBROUTINE xc_derivative_retain(deriv) | ^ Warning: 'xc_derivative_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_derivative_types.mod' due to: xc_derivative_types.o /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod base_hooks.mod kinds.mod xc_derivative_desc.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_derivative_types.mod' due to: xc_derivative_types.o /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod base_hooks.mod xc_derivative_desc.mod kinds.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_linked_list_xc_deriv.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/cp_linked_list_xc_deriv.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/common/cp_linked_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_types.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/cp_linked_list_xc_deriv.F cp_linked_list_xc_deriv.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:57:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/cp_linked_list_xc_deriv.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_linked_list_xc_deriv.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/cp_linked_list_xc_deriv.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_linked_list_xc_deriv.F90 /build/reproducible-path/cp2k-8.1/src/xc/cp_linked_list_xc_deriv.F:47:3: 47 | $:inst(nametype1, type1, type1in, type1out, eq, arrayeq, type1arrayEl, arrayEl, private_routines) @@ -5432,169 +5507,124 @@ Warning: 'cp_sll_deriv_less_q' defined but not used [-Wunused-function] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_linked_list_xc_deriv.mod' due to: cp_linked_list_xc_deriv.o /build/reproducible-path/cp2k-8.1/src/xc/cp_linked_list_xc_deriv.F /build/reproducible-path/cp2k-8.1/src/common/cp_linked_list.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_types.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_derivative_set_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_set_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod xc_derivative_types.mod pw_grid_types.mod xc_derivative_desc.mod base_hooks.mod message_passing.mod cp_linked_list_xc_deriv.mod pw_grids.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_derivative_set_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_set_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod xc_derivative_types.mod message_passing.mod kinds.mod pw_grids.mod xc_derivative_desc.mod cp_linked_list_xc_deriv.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_set_types.F xc_derivative_set_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:57:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_derivative_set_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_derivative_set_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_derivative_set_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_derivative_set_types.F90 /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_set_types.F:187:28: 187 | SUBROUTINE xc_dset_retain(deriv_set) | ^ Warning: 'xc_dset_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_derivative_set_types.mod' due to: xc_derivative_set_types.o /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_set_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod xc_derivative_types.mod pw_grid_types.mod xc_derivative_desc.mod base_hooks.mod message_passing.mod cp_linked_list_xc_deriv.mod pw_grids.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_derivative_set_types.mod' due to: xc_derivative_set_types.o /build/reproducible-path/cp2k-8.1/src/xc/xc_derivative_set_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod xc_derivative_types.mod message_passing.mod kinds.mod pw_grids.mod xc_derivative_desc.mod cp_linked_list_xc_deriv.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_rho_cflags_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_rho_cflags_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_rho_cflags_types.F xc_rho_cflags_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_rho_cflags_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_rho_cflags_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_rho_cflags_types.mod' due to: xc_rho_cflags_types.o /build/reproducible-path/cp2k-8.1/src/xc/xc_rho_cflags_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_rho_set_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_rho_set_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod xc_rho_cflags_types.mod pw_types.mod kinds.mod cp_array_utils.mod pw_methods.mod xc_input_constants.mod pw_spline_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_rho_set_types.F xc_rho_set_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_rho_set_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_rho_set_types.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_rho_set_types.F:163:31: + + 163 | SUBROUTINE xc_rho_set_retain(rho_set) + | ^ +Warning: 'xc_rho_set_retain' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_rho_set_types.mod' due to: xc_rho_set_types.o /build/reproducible-path/cp2k-8.1/src/xc/xc_rho_set_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod xc_rho_cflags_types.mod pw_types.mod kinds.mod cp_array_utils.mod pw_methods.mod xc_input_constants.mod pw_spline_utils.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_kpp1_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_kpp1_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod pw_types.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_kpp1_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_kpp1_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_kpp1_env_types.F qs_kpp1_env_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:57:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_kpp1_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_kpp1_env_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_kpp1_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_kpp1_env_types.F90 /build/reproducible-path/cp2k-8.1/src/qs_kpp1_env_types.F:156:25: 156 | SUBROUTINE kpp1_retain(kpp1_env) | ^ Warning: 'kpp1_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_kpp1_env_types.mod' due to: qs_kpp1_env_types.o /build/reproducible-path/cp2k-8.1/src/qs_kpp1_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod pw_types.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_kpp1_env_types.mod' due to: qs_kpp1_env_types.o /build/reproducible-path/cp2k-8.1/src/qs_kpp1_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_p_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_p_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_rho_types.mod preconditioner_types.mod qs_kpp1_env_types.mod hartree_local_types.mod cp_fm_types.mod cp_fm_vect.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_p_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_p_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod qs_kpp1_env_types.mod hartree_local_types.mod qs_rho_types.mod cp_fm_types.mod qs_local_rho_types.mod kinds.mod cp_fm_vect.mod base_hooks.mod cp_dbcsr_operations.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_p_env_types.F qs_p_env_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:57:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_p_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_p_env_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_p_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_p_env_types.F90 /build/reproducible-path/cp2k-8.1/src/qs_p_env_types.F:115:26: 115 | SUBROUTINE p_env_retain(p_env) | ^ Warning: 'p_env_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_p_env_types.mod' due to: qs_p_env_types.o /build/reproducible-path/cp2k-8.1/src/qs_p_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod qs_rho_types.mod preconditioner_types.mod qs_kpp1_env_types.mod hartree_local_types.mod cp_fm_types.mod cp_fm_vect.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_p_env_types.mod' due to: qs_p_env_types.o /build/reproducible-path/cp2k-8.1/src/qs_p_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod qs_kpp1_env_types.mod hartree_local_types.mod qs_rho_types.mod cp_fm_types.mod qs_local_rho_types.mod kinds.mod cp_fm_vect.mod base_hooks.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ec_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/ec_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pw_types.mod qs_period_efield_types.mod qs_force_types.mod qs_neighbor_list_types.mod qs_p_env_types.mod qs_dispersion_types.mod task_list_types.mod cp_fm_types.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ec_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/ec_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod task_list_types.mod pw_types.mod qs_dispersion_types.mod qs_period_efield_types.mod qs_force_types.mod qs_p_env_types.mod cp_fm_types.mod input_section_types.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ec_env_types.F ec_env_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:57:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ec_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ec_env_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ec_env_types.mod' due to: ec_env_types.o /build/reproducible-path/cp2k-8.1/src/ec_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pw_types.mod qs_period_efield_types.mod qs_force_types.mod qs_neighbor_list_types.mod qs_p_env_types.mod qs_dispersion_types.mod task_list_types.mod cp_fm_types.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'global_types.o' due to: /build/reproducible-path/cp2k-8.1/src/global_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod base_hooks.mod cp_blacs_env.mod machine.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/global_types.F global_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:58:00 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"global_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' global_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'global_types.mod' due to: global_types.o /build/reproducible-path/cp2k-8.1/src/global_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod base_hooks.mod cp_blacs_env.mod machine.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_compression_core_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_compression_core_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_compression_core_methods.F hfx_compression_core_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:58:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfxbase/hfx_compression_core_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/hfxbase/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_compression_core_methods.F90 -/build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_compression_core_methods.F:67:23: - - 67 | SUBROUTINE ints2ints(Ndata, packed_data, full_data) - | ^ -Warning: 'ints2ints' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_compression_core_methods.mod' due to: hfx_compression_core_methods.o /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_compression_core_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_compression_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_compression_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod hfx_compression_core_methods.mod base_hooks.mod cp_files.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_compression_methods.F hfx_compression_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_compression_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_compression_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_compression_methods.mod' due to: hfx_compression_methods.o /build/reproducible-path/cp2k-8.1/src/hfx_compression_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod hfx_compression_core_methods.mod base_hooks.mod cp_files.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_store_int_types.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_store_int_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod hfx_types.mod base_hooks.mod hfx_compression_methods.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_store_int_types.F semi_empirical_store_int_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_store_int_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_store_int_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_store_int_types.mod' due to: semi_empirical_store_int_types.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_store_int_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod hfx_types.mod base_hooks.mod hfx_compression_methods.mod kinds.mod memory_utilities.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:07:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ec_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ec_env_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ec_env_types.mod' due to: ec_env_types.o /build/reproducible-path/cp2k-8.1/src/ec_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod task_list_types.mod pw_types.mod qs_dispersion_types.mod qs_period_efield_types.mod qs_force_types.mod qs_p_env_types.mod cp_fm_types.mod input_section_types.mod kinds.mod base_hooks.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_types.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod cp_eri_mme_interface.mod libint_2c_3c.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_types.F mp2_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:16 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_types.mod' due to: mp2_types.o /build/reproducible-path/cp2k-8.1/src/mp2_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod cp_eri_mme_interface.mod libint_2c_3c.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_charges_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_charges_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_charges_types.F qs_charges_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_charges_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_charges_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_charges_types.mod' due to: qs_charges_types.o /build/reproducible-path/cp2k-8.1/src/qs_charges_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_wf_history_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_wf_history_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod cp_fm_types.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_wf_history_types.F qs_wf_history_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_wf_history_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_wf_history_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_wf_history_types.mod' due to: qs_wf_history_types.o /build/reproducible-path/cp2k-8.1/src/qs_wf_history_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod cp_fm_types.mod base_hooks.mod cp_dbcsr_operations.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod distribution_2d_types.mod admm_dm_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod cp_control_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod atprop_types.mod distribution_1d_types.mod atomic_kind_types.mod cp_result_types.mod qs_force_types.mod task_list_types.mod molecule_types.mod qs_energy_types.mod cp_blacs_env.mod cp_dbcsr_operations.mod kpoint_transitional.mod cp_para_env.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ks_types.F qs_ks_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_types.mod' due to: qs_ks_types.o /build/reproducible-path/cp2k-8.1/src/qs_ks_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod distribution_2d_types.mod admm_dm_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod cp_control_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod atprop_types.mod distribution_1d_types.mod atomic_kind_types.mod cp_result_types.mod qs_force_types.mod task_list_types.mod molecule_types.mod qs_energy_types.mod cp_blacs_env.mod cp_dbcsr_operations.mod kpoint_transitional.mod cp_para_env.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_active_space_types.mod transport_env_types.mod qs_rho_types.mod admm_types.mod pw_types.mod qs_subsys_types.mod mscfg_types.mod qs_neighbor_list_types.mod rel_control_types.mod et_coupling_types.mod hartree_local_types.mod cell_types.mod kpoint_types.mod qs_mo_types.mod qs_kind_types.mod qs_dispersion_types.mod distribution_2d_types.mod lri_environment_types.mod qs_period_efield_types.mod wannier_states_types.mod admm_dm_types.mod qs_oce_types.mod dm_ls_scf_types.mod cp_para_types.mod virial_types.mod qs_rho0_types.mod pw_env_types.mod qs_gcp_types.mod cp_ddapc_types.mod qs_dftb_types.mod cp_control_types.mod qs_rho_atom_types.mod rt_propagation_types.mod particle_types.mod xas_env_types.mod molecule_kind_types.mod qs_linres_types.mod fist_nonbond_env_types.mod qs_local_rho_types.mod qs_ks_qmmm_types.mod almo_scf_types.mod kg_environment_types.mod hfx_types.mod cp_subsys_types.mod qs_scf_types.mod atprop_types.mod semi_empirical_mpole_types.mod semi_empirical_types.mod distribution_1d_types.mod cp_fm_types.mod ec_env_types.mod global_types.mod semi_empirical_store_int_types.mod atomic_kind_types.mod mp2_types.mod scf_control_types.mod ewald_pw_types.mod qs_charges_types.mod cp_result_types.mod input_section_types.mod qs_force_types.mod qmmm_types_low.mod task_list_types.mod qs_wf_history_types.mod ewald_environment_types.mod qs_ks_types.mod molecule_types.mod qs_energy_types.mod input_constants.mod cp_blacs_env.mod qs_matrix_pools.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rel_control_types.mod cp_para_types.mod mp2_types.mod hfx_types.mod cp_subsys_types.mod qs_wf_history_types.mod semi_empirical_types.mod mscfg_types.mod qs_active_space_types.mod kpoint_types.mod qmmm_types_low.mod admm_dm_types.mod qs_ks_types.mod cp_result_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_charges_types.mod qs_force_types.mod qs_mo_types.mod qs_rho_types.mod admm_types.mod almo_scf_types.mod qs_scf_types.mod atprop_types.mod kg_environment_types.mod molecule_types.mod xas_env_types.mod dm_ls_scf_types.mod semi_empirical_store_int_types.mod global_types.mod fist_nonbond_env_types.mod qs_oce_types.mod transport_env_types.mod qs_dispersion_types.mod rt_propagation_types.mod cp_fm_types.mod qs_dftb_types.mod qs_local_rho_types.mod cp_ddapc_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_neighbor_list_types.mod pw_env_types.mod qs_rho0_types.mod ewald_environment_types.mod hartree_local_types.mod pw_types.mod qs_kind_types.mod qs_period_efield_types.mod wannier_states_types.mod distribution_1d_types.mod qs_linres_types.mod qs_gcp_types.mod input_section_types.mod qs_subsys_types.mod molecule_kind_types.mod virial_types.mod ewald_pw_types.mod et_coupling_types.mod semi_empirical_mpole_types.mod cp_control_types.mod qs_energy_types.mod qs_ks_qmmm_types.mod qs_rho_atom_types.mod ec_env_types.mod task_list_types.mod lri_environment_types.mod kinds.mod qs_matrix_pools.mod cp_blacs_env.mod base_hooks.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_environment_types.F qs_environment_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_environment_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_environment_types.mod' due to: qs_environment_types.o /build/reproducible-path/cp2k-8.1/src/qs_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_active_space_types.mod transport_env_types.mod qs_rho_types.mod admm_types.mod pw_types.mod qs_subsys_types.mod mscfg_types.mod qs_neighbor_list_types.mod rel_control_types.mod et_coupling_types.mod hartree_local_types.mod cell_types.mod kpoint_types.mod qs_mo_types.mod qs_kind_types.mod qs_dispersion_types.mod distribution_2d_types.mod lri_environment_types.mod qs_period_efield_types.mod wannier_states_types.mod admm_dm_types.mod qs_oce_types.mod dm_ls_scf_types.mod cp_para_types.mod virial_types.mod qs_rho0_types.mod pw_env_types.mod qs_gcp_types.mod cp_ddapc_types.mod qs_dftb_types.mod cp_control_types.mod qs_rho_atom_types.mod rt_propagation_types.mod particle_types.mod xas_env_types.mod molecule_kind_types.mod qs_linres_types.mod fist_nonbond_env_types.mod qs_local_rho_types.mod qs_ks_qmmm_types.mod almo_scf_types.mod kg_environment_types.mod hfx_types.mod cp_subsys_types.mod qs_scf_types.mod atprop_types.mod semi_empirical_mpole_types.mod semi_empirical_types.mod distribution_1d_types.mod cp_fm_types.mod ec_env_types.mod global_types.mod semi_empirical_store_int_types.mod atomic_kind_types.mod mp2_types.mod scf_control_types.mod ewald_pw_types.mod qs_charges_types.mod cp_result_types.mod input_section_types.mod qs_force_types.mod qmmm_types_low.mod task_list_types.mod qs_wf_history_types.mod ewald_environment_types.mod qs_ks_types.mod molecule_types.mod qs_energy_types.mod input_constants.mod cp_blacs_env.mod qs_matrix_pools.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_environment_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_environment_types.mod' due to: qs_environment_types.o /build/reproducible-path/cp2k-8.1/src/qs_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rel_control_types.mod cp_para_types.mod mp2_types.mod hfx_types.mod cp_subsys_types.mod qs_wf_history_types.mod semi_empirical_types.mod mscfg_types.mod qs_active_space_types.mod kpoint_types.mod qmmm_types_low.mod admm_dm_types.mod qs_ks_types.mod cp_result_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_charges_types.mod qs_force_types.mod qs_mo_types.mod qs_rho_types.mod admm_types.mod almo_scf_types.mod qs_scf_types.mod atprop_types.mod kg_environment_types.mod molecule_types.mod xas_env_types.mod dm_ls_scf_types.mod semi_empirical_store_int_types.mod global_types.mod fist_nonbond_env_types.mod qs_oce_types.mod transport_env_types.mod qs_dispersion_types.mod rt_propagation_types.mod cp_fm_types.mod qs_dftb_types.mod qs_local_rho_types.mod cp_ddapc_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_neighbor_list_types.mod pw_env_types.mod qs_rho0_types.mod ewald_environment_types.mod hartree_local_types.mod pw_types.mod qs_kind_types.mod qs_period_efield_types.mod wannier_states_types.mod distribution_1d_types.mod qs_linres_types.mod qs_gcp_types.mod input_section_types.mod qs_subsys_types.mod molecule_kind_types.mod virial_types.mod ewald_pw_types.mod et_coupling_types.mod semi_empirical_mpole_types.mod cp_control_types.mod qs_energy_types.mod qs_ks_qmmm_types.mod qs_rho_atom_types.mod ec_env_types.mod task_list_types.mod lri_environment_types.mod kinds.mod qs_matrix_pools.mod cp_blacs_env.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_energy_types.mod qmmm_types_low.mod cp_subsys_types.mod fist_environment_types.mod qs_environment_types.mod qs_energy_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_subsys_types.mod qmmm_types_low.mod fist_environment_types.mod qs_energy_types.mod fist_energy_types.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_types.F qmmm_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_types.mod' due to: qmmm_types.o /build/reproducible-path/cp2k-8.1/src/qmmm_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_energy_types.mod qmmm_types_low.mod cp_subsys_types.mod fist_environment_types.mod qs_environment_types.mod qs_energy_types.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_types.mod' due to: qmmm_types.o /build/reproducible-path/cp2k-8.1/src/qmmm_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_subsys_types.mod qmmm_types_low.mod fist_environment_types.mod qs_energy_types.mod fist_energy_types.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmmx_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmmx_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod qmmm_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmmx_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmmx_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod cp_subsys_types.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmmx_types.F qmmmx_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmmx_types.mod' due to: qmmmx_types.o /build/reproducible-path/cp2k-8.1/src/qmmmx_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod qmmm_types.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmmx_types.mod' due to: qmmmx_types.o /build/reproducible-path/cp2k-8.1/src/qmmmx_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod cp_subsys_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'embed_types.o' due to: /build/reproducible-path/cp2k-8.1/src/embed_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod pw_types.mod cell_types.mod atomic_kind_list_types.mod lri_environment_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod particle_list_types.mod distribution_1d_types.mod cp_fm_types.mod molecule_list_types.mod atomic_kind_types.mod cp_result_types.mod input_section_types.mod molecule_types.mod kinds.mod cp_para_env.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'embed_types.o' due to: /build/reproducible-path/cp2k-8.1/src/embed_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cp_result_types.mod particle_types.mod cell_types.mod molecule_types.mod particle_list_types.mod cp_fm_types.mod molecule_kind_list_types.mod atomic_kind_types.mod pw_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod molecule_list_types.mod atomic_kind_list_types.mod lri_environment_types.mod cp_log_handling.mod kinds.mod cp_para_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/embed_types.F embed_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"embed_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' embed_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'embed_types.mod' due to: embed_types.o /build/reproducible-path/cp2k-8.1/src/embed_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod pw_types.mod cell_types.mod atomic_kind_list_types.mod lri_environment_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod particle_list_types.mod distribution_1d_types.mod cp_fm_types.mod molecule_list_types.mod atomic_kind_types.mod cp_result_types.mod input_section_types.mod molecule_types.mod kinds.mod cp_para_env.mod cp_log_handling.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"embed_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' embed_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'embed_types.mod' due to: embed_types.o /build/reproducible-path/cp2k-8.1/src/embed_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cp_result_types.mod particle_types.mod cell_types.mod molecule_types.mod particle_list_types.mod cp_fm_types.mod molecule_kind_list_types.mod atomic_kind_types.mod pw_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod molecule_list_types.mod atomic_kind_list_types.mod lri_environment_types.mod cp_log_handling.mod kinds.mod cp_para_env.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eip_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/eip_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_kind_list_types.mod molecule_list_types.mod molecule_types.mod atomic_kind_types.mod input_section_types.mod particle_types.mod virial_types.mod cp_subsys_types.mod particle_list_types.mod cell_types.mod atomic_kind_list_types.mod distribution_1d_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/eip_environment_types.F eip_environment_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eip_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eip_environment_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eip_environment_types.mod' due to: eip_environment_types.o /build/reproducible-path/cp2k-8.1/src/eip_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_kind_list_types.mod molecule_list_types.mod molecule_types.mod atomic_kind_types.mod input_section_types.mod particle_types.mod virial_types.mod cp_subsys_types.mod particle_list_types.mod cell_types.mod atomic_kind_list_types.mod distribution_1d_types.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fp_types.o' due to: /build/reproducible-path/cp2k-8.1/src/fp_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fp_types.F fp_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fp_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fp_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fp_types.mod' due to: fp_types.o /build/reproducible-path/cp2k-8.1/src/fp_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod cp_log_handling.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_energy_types.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_energy_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_energy_types.F mixed_energy_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_energy_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_energy_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_energy_types.mod' due to: mixed_energy_types.o /build/reproducible-path/cp2k-8.1/src/mixed_energy_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_cdft_types.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_cdft_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_cdft_types.mod pw_env_types.mod cp_fm_types.mod cp_blacs_env.mod cp_log_handling.mod base_hooks.mod cp_array_utils.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_cdft_types.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_cdft_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_env_types.mod qs_kind_types.mod qs_cdft_types.mod cp_fm_types.mod cp_log_handling.mod cp_array_utils.mod kinds.mod base_hooks.mod cp_blacs_env.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_cdft_types.F mixed_cdft_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_cdft_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_cdft_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_cdft_types.mod' due to: mixed_cdft_types.o /build/reproducible-path/cp2k-8.1/src/mixed_cdft_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_cdft_types.mod pw_env_types.mod cp_fm_types.mod cp_blacs_env.mod cp_log_handling.mod base_hooks.mod cp_array_utils.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_cdft_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_cdft_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_cdft_types.mod' due to: mixed_cdft_types.o /build/reproducible-path/cp2k-8.1/src/mixed_cdft_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_env_types.mod qs_kind_types.mod qs_cdft_types.mod cp_fm_types.mod cp_log_handling.mod cp_array_utils.mod kinds.mod base_hooks.mod cp_blacs_env.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod qs_rho_types.mod mixed_energy_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod particle_list_types.mod distribution_1d_types.mod molecule_list_types.mod atomic_kind_types.mod mixed_cdft_types.mod cp_result_types.mod input_section_types.mod molecule_types.mod kinds.mod cp_para_env.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cp_result_types.mod mixed_cdft_types.mod particle_types.mod cell_types.mod qs_rho_types.mod molecule_types.mod particle_list_types.mod molecule_kind_list_types.mod atomic_kind_types.mod mixed_energy_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod molecule_list_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod cp_para_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_environment_types.F mixed_environment_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_environment_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_environment_types.mod' due to: mixed_environment_types.o /build/reproducible-path/cp2k-8.1/src/mixed_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod qs_rho_types.mod mixed_energy_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod particle_list_types.mod distribution_1d_types.mod molecule_list_types.mod atomic_kind_types.mod mixed_cdft_types.mod cp_result_types.mod input_section_types.mod molecule_types.mod kinds.mod cp_para_env.mod cp_log_handling.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_environment_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_environment_types.mod' due to: mixed_environment_types.o /build/reproducible-path/cp2k-8.1/src/mixed_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cp_result_types.mod mixed_cdft_types.mod particle_types.mod cell_types.mod qs_rho_types.mod molecule_types.mod particle_list_types.mod molecule_kind_list_types.mod atomic_kind_types.mod mixed_energy_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod molecule_list_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod cp_para_env.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/force_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pwdft_environment_types.mod mixed_energy_types.mod fist_energy_types.mod nnp_environment_types.mod fist_environment_types.mod cell_types.mod qmmmx_types.mod cp_para_types.mod qs_environment_types.mod embed_types.mod eip_environment_types.mod metadynamics_types.mod cp_subsys_types.mod global_types.mod fp_types.mod input_section_types.mod mixed_environment_types.mod qmmm_types.mod qs_energy_types.mod kinds.mod cp_para_env.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/force_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod fist_environment_types.mod eip_environment_types.mod cell_types.mod nnp_environment_types.mod fp_types.mod pwdft_environment_types.mod global_types.mod qmmmx_types.mod embed_types.mod qs_environment_types.mod qmmm_types.mod metadynamics_types.mod mixed_energy_types.mod mixed_environment_types.mod input_section_types.mod qs_energy_types.mod fist_energy_types.mod cp_log_handling.mod kinds.mod cp_para_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/force_env_types.F force_env_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 03:59:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_env_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_env_types.F90 /build/reproducible-path/cp2k-8.1/src/force_env_types.F:702:45: 702 | i_force_eval(1) = main_force_eval | ^ Warning: 'main_force_eval' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_env_types.mod' due to: force_env_types.o /build/reproducible-path/cp2k-8.1/src/force_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pwdft_environment_types.mod mixed_energy_types.mod fist_energy_types.mod nnp_environment_types.mod fist_environment_types.mod cell_types.mod qmmmx_types.mod cp_para_types.mod qs_environment_types.mod embed_types.mod eip_environment_types.mod metadynamics_types.mod cp_subsys_types.mod global_types.mod fp_types.mod input_section_types.mod mixed_environment_types.mod qmmm_types.mod qs_energy_types.mod kinds.mod cp_para_env.mod cp_log_handling.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'free_energy_types.o' due to: /build/reproducible-path/cp2k-8.1/src/free_energy_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/free_energy_types.F free_energy_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"free_energy_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' free_energy_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'free_energy_types.mod' due to: free_energy_types.o /build/reproducible-path/cp2k-8.1/src/free_energy_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'extended_system_types.o' due to: /build/reproducible-path/cp2k-8.1/src/extended_system_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/extended_system_types.F extended_system_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"extended_system_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' extended_system_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'extended_system_types.mod' due to: extended_system_types.o /build/reproducible-path/cp2k-8.1/src/extended_system_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod base_hooks.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_env_types.mod' due to: force_env_types.o /build/reproducible-path/cp2k-8.1/src/force_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod fist_environment_types.mod eip_environment_types.mod cell_types.mod nnp_environment_types.mod fp_types.mod pwdft_environment_types.mod global_types.mod qmmmx_types.mod embed_types.mod qs_environment_types.mod qmmm_types.mod metadynamics_types.mod mixed_energy_types.mod mixed_environment_types.mod input_section_types.mod qs_energy_types.mod fist_energy_types.mod cp_log_handling.mod kinds.mod cp_para_env.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'csvr_system_types.o' due to: /build/reproducible-path/cp2k-8.1/src/csvr_system_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod extended_system_types.mod simpar_types.mod parallel_rng_types.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/csvr_system_types.F csvr_system_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"csvr_system_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'csvr_system_types.mod' due to: csvr_system_types.o /build/reproducible-path/cp2k-8.1/src/csvr_system_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod extended_system_types.mod simpar_types.mod parallel_rng_types.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'al_system_types.o' due to: /build/reproducible-path/cp2k-8.1/src/al_system_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod simpar_types.mod input_section_types.mod kinds.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/al_system_types.F al_system_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"al_system_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' al_system_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'al_system_types.mod' due to: al_system_types.o /build/reproducible-path/cp2k-8.1/src/al_system_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod simpar_types.mod input_section_types.mod kinds.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gle_system_types.o' due to: /build/reproducible-path/cp2k-8.1/src/gle_system_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod extended_system_types.mod parallel_rng_types.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gle_system_types.o' due to: /build/reproducible-path/cp2k-8.1/src/gle_system_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod extended_system_types.mod input_section_types.mod kinds.mod string_utilities.mod bibliography.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/gle_system_types.F gle_system_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"gle_system_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gle_system_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'gle_system_types.mod' due to: gle_system_types.o /build/reproducible-path/cp2k-8.1/src/gle_system_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod extended_system_types.mod parallel_rng_types.mod string_utilities.mod base_hooks.mod bibliography.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:40 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"gle_system_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gle_system_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'gle_system_types.mod' due to: gle_system_types.o /build/reproducible-path/cp2k-8.1/src/gle_system_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod extended_system_types.mod input_section_types.mod kinds.mod string_utilities.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'al_system_types.o' due to: /build/reproducible-path/cp2k-8.1/src/al_system_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod extended_system_types.mod simpar_types.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/al_system_types.F al_system_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"al_system_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' al_system_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'al_system_types.mod' due to: al_system_types.o /build/reproducible-path/cp2k-8.1/src/al_system_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod extended_system_types.mod simpar_types.mod base_hooks.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'csvr_system_types.o' due to: /build/reproducible-path/cp2k-8.1/src/csvr_system_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod extended_system_types.mod simpar_types.mod input_section_types.mod kinds.mod string_utilities.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/csvr_system_types.F csvr_system_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"csvr_system_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'csvr_system_types.mod' due to: csvr_system_types.o /build/reproducible-path/cp2k-8.1/src/csvr_system_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod extended_system_types.mod simpar_types.mod input_section_types.mod kinds.mod string_utilities.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'thermostat_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 csvr_system_types.mod gle_system_types.mod al_system_types.mod extended_system_types.mod input_section_types.mod simpar_types.mod input_constants.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'thermostat_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod simpar_types.mod al_system_types.mod gle_system_types.mod input_section_types.mod csvr_system_types.mod kinds.mod input_constants.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_types.F thermostat_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/thermostat_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermostat_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'thermostat_types.mod' due to: thermostat_types.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 csvr_system_types.mod gle_system_types.mod al_system_types.mod extended_system_types.mod input_section_types.mod simpar_types.mod input_constants.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/thermostat_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermostat_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'thermostat_types.mod' due to: thermostat_types.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod simpar_types.mod al_system_types.mod gle_system_types.mod input_section_types.mod csvr_system_types.mod kinds.mod input_constants.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'thermostat_mapping.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod cp_para_types.mod extended_system_types.mod simpar_types.mod cell_types.mod distribution_1d_types.mod input_constants.mod base_hooks.mod message_passing.mod util.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'thermostat_mapping.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod molecule_types.mod simpar_types.mod cell_types.mod distribution_1d_types.mod molecule_kind_types.mod message_passing.mod util.mod kinds.mod input_constants.mod memory_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F thermostat_mapping.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/thermostat_mapping.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermostat_mapping.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/thermostat_mapping.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermostat_mapping.F90 /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F:576:38: 576 | ALLOCATE (map_info%s_kin(nsize)) @@ -5640,104 +5670,130 @@ 100 | INTEGER, DIMENSION(:), POINTER :: const_mol, tot_const | ^ note: 'MEM[(struct array01_integer(kind=4) &)&const_mol].dim[0].ubound' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'thermostat_mapping.mod' due to: thermostat_mapping.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod cp_para_types.mod extended_system_types.mod simpar_types.mod cell_types.mod distribution_1d_types.mod input_constants.mod base_hooks.mod message_passing.mod util.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'thermostat_mapping.mod' due to: thermostat_mapping.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_mapping.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod molecule_types.mod simpar_types.mod cell_types.mod distribution_1d_types.mod molecule_kind_types.mod message_passing.mod util.mod kinds.mod input_constants.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'extended_system_mapping.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_mapping.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod simpar_types.mod distribution_1d_types.mod input_constants.mod thermostat_mapping.mod base_hooks.mod message_passing.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'extended_system_mapping.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_mapping.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod molecule_types.mod simpar_types.mod thermostat_types.mod distribution_1d_types.mod molecule_kind_types.mod message_passing.mod kinds.mod thermostat_mapping.mod input_constants.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_mapping.F extended_system_mapping.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:16 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/extended_system_mapping.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' extended_system_mapping.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'extended_system_mapping.mod' due to: extended_system_mapping.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_mapping.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod simpar_types.mod distribution_1d_types.mod input_constants.mod thermostat_mapping.mod base_hooks.mod message_passing.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_types.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod cell_types.mod input_constants.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_types.F topology_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:19 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_types.mod' due to: topology_types.o /build/reproducible-path/cp2k-8.1/src/topology_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 colvar_types.mod cell_types.mod input_constants.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'string_table.mod' due to: string_table.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_binary_restarts.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_binary_restarts.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod input_section_types.mod topology_types.mod particle_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod print_messages.mod string_table.mod cp_files.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_binary_restarts.F input_cp2k_binary_restarts.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_binary_restarts.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_binary_restarts.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_binary_restarts.mod' due to: input_cp2k_binary_restarts.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_binary_restarts.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod input_section_types.mod topology_types.mod particle_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod print_messages.mod string_table.mod cp_files.mod physcon.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:08:56 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/extended_system_mapping.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' extended_system_mapping.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'extended_system_mapping.mod' due to: extended_system_mapping.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_mapping.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod molecule_types.mod simpar_types.mod thermostat_types.mod distribution_1d_types.mod molecule_kind_types.mod message_passing.mod kinds.mod thermostat_mapping.mod input_constants.mod base_hooks.mod true /build/reproducible-path/cp2k-8.1/Makefile:484: update target '/build/reproducible-path/cp2k-8.1/obj/git-ref' due to: FORCE echo git:0b61f2f > "/build/reproducible-path/cp2k-8.1/obj/git-ref.tmp" cmp "/build/reproducible-path/cp2k-8.1/obj/git-ref.tmp" "/build/reproducible-path/cp2k-8.1/obj/git-ref" || mv -f "/build/reproducible-path/cp2k-8.1/obj/git-ref.tmp" "/build/reproducible-path/cp2k-8.1/obj/git-ref" cmp: /build/reproducible-path/cp2k-8.1/obj/git-ref: No such file or directory -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp2k_info.o' due to: /build/reproducible-path/cp2k-8.1/src/cp2k_info.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod machine.mod input_constants.mod kinds.mod string_utilities.mod /build/reproducible-path/cp2k-8.1/obj/git-ref +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp2k_info.o' due to: /build/reproducible-path/cp2k-8.1/src/cp2k_info.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod string_utilities.mod machine.mod input_constants.mod kinds.mod /build/reproducible-path/cp2k-8.1/obj/git-ref /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp2k_info.F cp2k_info.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp2k_info.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k_info.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp2k_info.mod' due to: cp2k_info.o /build/reproducible-path/cp2k-8.1/src/cp2k_info.F machine.mod input_constants.mod kinds.mod string_utilities.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:09:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp2k_info.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k_info.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp2k_info.mod' due to: cp2k_info.o /build/reproducible-path/cp2k-8.1/src/cp2k_info.F string_utilities.mod machine.mod input_constants.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'motion_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod virial_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod cell_types.mod particle_types.mod input_constants.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp2k_info.mod cp_output_handling.mod machine.mod physcon.mod cp_units.mod kinds.mod particle_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'motion_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod particle_list_types.mod particle_types.mod cell_types.mod virial_types.mod force_env_types.mod mathlib.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod particle_methods.mod cp_output_handling.mod physcon.mod cp2k_info.mod machine.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion_utils.F motion_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' motion_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'motion_utils.mod' due to: motion_utils.o /build/reproducible-path/cp2k-8.1/src/motion_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod virial_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod cell_types.mod particle_types.mod input_constants.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp2k_info.mod cp_output_handling.mod machine.mod physcon.mod cp_units.mod kinds.mod particle_methods.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:09:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' motion_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'motion_utils.mod' due to: motion_utils.o /build/reproducible-path/cp2k-8.1/src/motion_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod particle_list_types.mod particle_types.mod cell_types.mod virial_types.mod force_env_types.mod mathlib.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod particle_methods.mod cp_output_handling.mod physcon.mod cp2k_info.mod machine.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'thermostat_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod particle_types.mod molecule_kind_types.mod simpar_types.mod particle_list_types.mod distribution_1d_types.mod molecule_list_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types.mod molecule_types.mod input_constants.mod kinds.mod motion_utils.mod cp_output_handling.mod physcon.mod message_passing.mod cp_log_handling.mod base_hooks.mod machine.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'thermostat_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod particle_list_types.mod thermostat_types.mod atomic_kind_types.mod qmmm_types.mod extended_system_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod shell_potential_types.mod molecule_list_types.mod simpar_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod motion_utils.mod machine.mod base_hooks.mod input_constants.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_utils.F thermostat_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/thermostat_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermostat_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:09:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/thermostat_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermostat_utils.F90 /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_utils.F:317:38: 317 | IF ((nmolecule == 1) .AND. (nkind == 1)) nointer = .FALSE. | ^ Warning: 'nmolecule' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'thermostat_utils.mod' due to: thermostat_utils.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod particle_types.mod molecule_kind_types.mod simpar_types.mod particle_list_types.mod distribution_1d_types.mod molecule_list_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types.mod molecule_types.mod input_constants.mod kinds.mod motion_utils.mod cp_output_handling.mod physcon.mod message_passing.mod cp_log_handling.mod base_hooks.mod machine.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'thermostat_utils.mod' due to: thermostat_utils.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod particle_list_types.mod thermostat_types.mod atomic_kind_types.mod qmmm_types.mod extended_system_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod shell_potential_types.mod molecule_list_types.mod simpar_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod motion_utils.mod machine.mod base_hooks.mod input_constants.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_types.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod colvar_types.mod kinds.mod input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_types.F topology_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:09:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_types.mod' due to: topology_types.o /build/reproducible-path/cp2k-8.1/src/topology_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod colvar_types.mod kinds.mod input_constants.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'string_table.mod' due to: string_table.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_binary_restarts.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_binary_restarts.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod particle_types.mod topology_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod physcon.mod cp_output_handling.mod print_messages.mod string_table.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_binary_restarts.F input_cp2k_binary_restarts.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:09:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_binary_restarts.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_binary_restarts.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_binary_restarts.mod' due to: input_cp2k_binary_restarts.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_binary_restarts.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod particle_types.mod topology_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod physcon.mod cp_output_handling.mod print_messages.mod string_table.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'extended_system_init.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod global_types.mod molecule_types.mod cp_para_types.mod extended_system_types.mod input_section_types.mod thermostat_types.mod simpar_types.mod cell_types.mod distribution_1d_types.mod extended_system_mapping.mod input_constants.mod input_cp2k_binary_restarts.mod base_hooks.mod thermostat_utils.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'extended_system_init.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod molecule_types.mod global_types.mod simpar_types.mod thermostat_types.mod cell_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod kinds.mod input_constants.mod extended_system_mapping.mod thermostat_utils.mod input_cp2k_binary_restarts.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_init.F extended_system_init.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/extended_system_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' extended_system_init.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'extended_system_init.mod' due to: extended_system_init.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod global_types.mod molecule_types.mod cp_para_types.mod extended_system_types.mod input_section_types.mod thermostat_types.mod simpar_types.mod cell_types.mod distribution_1d_types.mod extended_system_mapping.mod input_constants.mod input_cp2k_binary_restarts.mod base_hooks.mod thermostat_utils.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:09:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/extended_system_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' extended_system_init.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'extended_system_init.mod' due to: extended_system_init.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod molecule_types.mod global_types.mod simpar_types.mod thermostat_types.mod cell_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod kinds.mod input_constants.mod extended_system_mapping.mod thermostat_utils.mod input_cp2k_binary_restarts.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'barostat_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/barostat_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod extended_system_types.mod input_section_types.mod simpar_types.mod force_env_types.mod cell_types.mod input_constants.mod base_hooks.mod extended_system_init.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'barostat_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/barostat_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod input_section_types.mod global_types.mod simpar_types.mod cell_types.mod force_env_types.mod extended_system_init.mod kinds.mod input_constants.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/barostat_types.F barostat_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/barostat_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' barostat_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'barostat_types.mod' due to: barostat_types.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/barostat_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod extended_system_types.mod input_section_types.mod simpar_types.mod force_env_types.mod cell_types.mod input_constants.mod base_hooks.mod extended_system_init.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:09:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/barostat_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' barostat_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'barostat_types.mod' due to: barostat_types.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/barostat_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod input_section_types.mod global_types.mod simpar_types.mod cell_types.mod force_env_types.mod extended_system_init.mod kinds.mod input_constants.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'thermal_region_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermal_region_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermal_region_types.F thermal_region_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermal_region_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermal_region_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'thermal_region_types.mod' due to: thermal_region_types.o /build/reproducible-path/cp2k-8.1/src/motion/thermal_region_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_ener_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_ener_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_ener_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_ener_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/md_ener_types.F md_ener_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:51 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_ener_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_ener_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_ener_types.mod' due to: md_ener_types.o /build/reproducible-path/cp2k-8.1/src/motion/md_ener_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'reftraj_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/reftraj_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/reftraj_types.F reftraj_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/reftraj_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' reftraj_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'reftraj_types.mod' due to: reftraj_types.o /build/reproducible-path/cp2k-8.1/src/motion/reftraj_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:09:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_ener_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_ener_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_ener_types.mod' due to: md_ener_types.o /build/reproducible-path/cp2k-8.1/src/motion/md_ener_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rmsd.o' due to: /build/reproducible-path/cp2k-8.1/src/rmsd.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod kinds.mod mathlib.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rmsd.o' due to: /build/reproducible-path/cp2k-8.1/src/rmsd.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod mathlib.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rmsd.F rmsd.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rmsd.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rmsd.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rmsd.mod' due to: rmsd.o /build/reproducible-path/cp2k-8.1/src/rmsd.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod kinds.mod mathlib.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:09:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rmsd.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rmsd.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rmsd.mod' due to: rmsd.o /build/reproducible-path/cp2k-8.1/src/rmsd.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod mathlib.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_result_methods.mod' due to: cp_result_methods.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_environment_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_environment_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_list_types.mod cp_result_types.mod mixed_energy_types.mod input_section_types.mod virial_types.mod cp_result_methods.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_environment_utils.F mixed_environment_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:10:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_environment_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_environment_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_environment_utils.mod' due to: mixed_environment_utils.o /build/reproducible-path/cp2k-8.1/src/mixed_environment_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_list_types.mod cp_result_types.mod mixed_energy_types.mod input_section_types.mod virial_types.mod cp_result_methods.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint_fxd.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint_fxd.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod molecule_types.mod force_env_types.mod particle_list_types.mod atomic_kind_list_types.mod cell_types.mod distribution_1d_types.mod particle_types.mod colvar_types.mod molecule_kind_types.mod atomic_kind_types.mod message_passing.mod util.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/constraint_fxd.F constraint_fxd.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:10:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_fxd.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_fxd.F90 +/build/reproducible-path/cp2k-8.1/src/constraint_fxd.F:241:86: + + 241 | shell_particle_set(shell_index)%f(:) = force(:, natom + shell_index) + | ^ +Warning: 'shell_particle_set.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/constraint_fxd.F:241:86: Warning: 'shell_particle_set.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/constraint_fxd.F:241:86: Warning: 'shell_particle_set.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/constraint_fxd.F:240:75: + + 240 | core_particle_set(shell_index)%f(:) = force(:, iparticle) + | ^ +Warning: 'core_particle_set.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/constraint_fxd.F:240:75: Warning: 'core_particle_set.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/constraint_fxd.F:240:75: Warning: 'core_particle_set.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint_fxd.mod' due to: constraint_fxd.o /build/reproducible-path/cp2k-8.1/src/constraint_fxd.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod molecule_types.mod force_env_types.mod particle_list_types.mod atomic_kind_list_types.mod cell_types.mod distribution_1d_types.mod particle_types.mod colvar_types.mod molecule_kind_types.mod atomic_kind_types.mod message_passing.mod util.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pair_potential_coulomb.o' due to: /build/reproducible-path/cp2k-8.1/src/pair_potential_coulomb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod mathconstants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pair_potential_coulomb.o' due to: /build/reproducible-path/cp2k-8.1/src/pair_potential_coulomb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pair_potential_coulomb.F pair_potential_coulomb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pair_potential_coulomb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pair_potential_coulomb.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pair_potential_coulomb.mod' due to: pair_potential_coulomb.o /build/reproducible-path/cp2k-8.1/src/pair_potential_coulomb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod mathconstants.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:10:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pair_potential_coulomb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pair_potential_coulomb.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pair_potential_coulomb.mod' due to: pair_potential_coulomb.o /build/reproducible-path/cp2k-8.1/src/pair_potential_coulomb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod base_hooks.mod mathconstants.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atoms_input.o' due to: /build/reproducible-path/cp2k-8.1/src/atoms_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod shell_potential_types.mod particle_types.mod cell_types.mod topology_types.mod input_section_types.mod atomic_kind_types.mod cp_units.mod cp_log_handling.mod cp_linked_list_input.mod kinds.mod base_hooks.mod memory_utilities.mod string_utilities.mod string_table.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atoms_input.F atoms_input.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:10:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atoms_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atoms_input.F90 +/build/reproducible-path/cp2k-8.1/src/atoms_input.F:441:84: + + 441 | core_particle_set(sh_index)%r(:) = rc(:, ishell)*unit_conv_core + | ^ +Warning: 'unit_conv_core' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atoms_input.mod' due to: atoms_input.o /build/reproducible-path/cp2k-8.1/src/atoms_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod shell_potential_types.mod particle_types.mod cell_types.mod topology_types.mod input_section_types.mod atomic_kind_types.mod cp_units.mod cp_log_handling.mod cp_linked_list_input.mod kinds.mod base_hooks.mod memory_utilities.mod string_utilities.mod string_table.mod cp_parser_methods.mod true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fparser.mod' due to: fparser.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pair_potential_util.o' due to: /build/reproducible-path/cp2k-8.1/src/pair_potential_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod base_hooks.mod fparser.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'splines_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/splines_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod base_hooks.mod cp_log_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/splines_methods.F splines_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:10:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"splines_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' splines_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'splines_methods.mod' due to: splines_methods.o /build/reproducible-path/cp2k-8.1/src/splines_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod base_hooks.mod cp_log_handling.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pair_potential_util.o' due to: /build/reproducible-path/cp2k-8.1/src/pair_potential_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod kinds.mod fparser.mod physcon.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pair_potential_util.F pair_potential_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pair_potential_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pair_potential_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:10:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pair_potential_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pair_potential_util.F90 /build/reproducible-path/cp2k-8.1/src/pair_potential_util.F:148:31: 148 | value = value + lvalue | ^ Warning: 'pp' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pair_potential_util.mod' due to: pair_potential_util.o /build/reproducible-path/cp2k-8.1/src/pair_potential_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod base_hooks.mod fparser.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'splines_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/splines_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod base_hooks.mod kinds.mod cp_log_handling.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/splines_methods.F splines_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"splines_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' splines_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'splines_methods.mod' due to: splines_methods.o /build/reproducible-path/cp2k-8.1/src/splines_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod base_hooks.mod kinds.mod cp_log_handling.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pair_potential_util.mod' due to: pair_potential_util.o /build/reproducible-path/cp2k-8.1/src/pair_potential_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod kinds.mod fparser.mod physcon.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pair_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/pair_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod splines_types.mod pair_potential_types.mod pair_potential_util.mod cp_log_handling.mod fparser.mod util.mod base_hooks.mod splines_methods.mod string_table.mod cp_files.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pair_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/pair_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod splines_types.mod atomic_kind_types.mod util.mod cp_log_handling.mod cp_files.mod kinds.mod base_hooks.mod fparser.mod physcon.mod splines_methods.mod string_table.mod pair_potential_util.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pair_potential.F pair_potential.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:00:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pair_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pair_potential.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:10:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pair_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pair_potential.F90 /build/reproducible-path/cp2k-8.1/src/pair_potential.F:1025:77: 1025 | pot%spl_f%rcutsq_f = (min_sigma6/m_sigma6)**(1.0_dp/3.0_dp) @@ -5753,21 +5809,11 @@ 944 | m_sigma6, min_sigma6, rcovi, rcovj | ^ Warning: 'm_sigma6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pair_potential.mod' due to: pair_potential.o /build/reproducible-path/cp2k-8.1/src/pair_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod splines_types.mod pair_potential_types.mod pair_potential_util.mod cp_log_handling.mod fparser.mod util.mod base_hooks.mod splines_methods.mod string_table.mod cp_files.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atoms_input.o' due to: /build/reproducible-path/cp2k-8.1/src/atoms_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod atomic_kind_types.mod shell_potential_types.mod input_section_types.mod particle_types.mod topology_types.mod cell_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod memory_utilities.mod string_table.mod cp_linked_list_input.mod cp_units.mod kinds.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atoms_input.F atoms_input.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:01:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atoms_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atoms_input.F90 -/build/reproducible-path/cp2k-8.1/src/atoms_input.F:441:84: - - 441 | core_particle_set(sh_index)%r(:) = rc(:, ishell)*unit_conv_core - | ^ -Warning: 'unit_conv_core' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atoms_input.mod' due to: atoms_input.o /build/reproducible-path/cp2k-8.1/src/atoms_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod atomic_kind_types.mod shell_potential_types.mod input_section_types.mod particle_types.mod topology_types.mod cell_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod memory_utilities.mod string_table.mod cp_linked_list_input.mod cp_units.mod kinds.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pair_potential.mod' due to: pair_potential.o /build/reproducible-path/cp2k-8.1/src/pair_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod splines_types.mod atomic_kind_types.mod util.mod cp_log_handling.mod cp_files.mod kinds.mod base_hooks.mod fparser.mod physcon.mod splines_methods.mod string_table.mod pair_potential_util.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_fields_all.o' due to: /build/reproducible-path/cp2k-8.1/src/force_fields_all.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod shell_potential_types.mod cell_types.mod force_field_kind_types.mod splines_types.mod pair_potential_types.mod force_field_types.mod particle_types.mod molecule_kind_types.mod external_potential_types.mod atomic_kind_types.mod damping_dipole_types.mod input_section_types.mod qmmm_types_low.mod ewald_environment_types.mod molecule_types.mod input_constants.mod string_utilities.mod pair_potential_coulomb.mod mathconstants.mod kinds.mod qmmm_ff_fist.mod physcon.mod cp_linked_list_input.mod pair_potential.mod memory_utilities.mod input_cp2k_binary_restarts.mod cp_log_handling.mod base_hooks.mod atoms_input.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_fields_all.o' due to: /build/reproducible-path/cp2k-8.1/src/force_fields_all.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod particle_types.mod cell_types.mod force_field_kind_types.mod molecule_types.mod damping_dipole_types.mod atomic_kind_types.mod input_val_types.mod ewald_environment_types.mod external_potential_types.mod splines_types.mod input_section_types.mod molecule_kind_types.mod pair_potential_types.mod shell_potential_types.mod force_field_types.mod cp_log_handling.mod kinds.mod physcon.mod qmmm_ff_fist.mod string_utilities.mod memory_utilities.mod pair_potential_coulomb.mod atoms_input.mod base_hooks.mod mathconstants.mod cp_linked_list_input.mod input_constants.mod input_cp2k_binary_restarts.mod pair_potential.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/force_fields_all.F force_fields_all.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:01:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields_all.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields_all.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:10:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields_all.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields_all.F90 /build/reproducible-path/cp2k-8.1/src/force_fields_all.F:2659:39: 2659 | rmin = rmin2_a + rmin2_b @@ -5780,42 +5826,16 @@ | ^ Warning: 'epsilon_b' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/force_fields_all.F:2661:56: Warning: 'epsilon_a' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_fields_all.mod' due to: force_fields_all.o /build/reproducible-path/cp2k-8.1/src/force_fields_all.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod shell_potential_types.mod cell_types.mod force_field_kind_types.mod splines_types.mod pair_potential_types.mod force_field_types.mod particle_types.mod molecule_kind_types.mod external_potential_types.mod atomic_kind_types.mod damping_dipole_types.mod input_section_types.mod qmmm_types_low.mod ewald_environment_types.mod molecule_types.mod input_constants.mod string_utilities.mod pair_potential_coulomb.mod mathconstants.mod kinds.mod qmmm_ff_fist.mod physcon.mod cp_linked_list_input.mod pair_potential.mod memory_utilities.mod input_cp2k_binary_restarts.mod cp_log_handling.mod base_hooks.mod atoms_input.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_fields_all.mod' due to: force_fields_all.o /build/reproducible-path/cp2k-8.1/src/force_fields_all.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod particle_types.mod cell_types.mod force_field_kind_types.mod molecule_types.mod damping_dipole_types.mod atomic_kind_types.mod input_val_types.mod ewald_environment_types.mod external_potential_types.mod splines_types.mod input_section_types.mod molecule_kind_types.mod pair_potential_types.mod shell_potential_types.mod force_field_types.mod cp_log_handling.mod kinds.mod physcon.mod qmmm_ff_fist.mod string_utilities.mod memory_utilities.mod pair_potential_coulomb.mod atoms_input.mod base_hooks.mod mathconstants.mod cp_linked_list_input.mod input_constants.mod input_cp2k_binary_restarts.mod pair_potential.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_fields_util.o' due to: /build/reproducible-path/cp2k-8.1/src/force_fields_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod force_field_kind_types.mod pair_potential_types.mod force_field_types.mod particle_types.mod molecule_kind_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod colvar_types.mod ewald_environment_types.mod molecule_types.mod string_utilities.mod kinds.mod cp_output_handling.mod force_fields_all.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_fields_util.o' due to: /build/reproducible-path/cp2k-8.1/src/force_fields_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod particle_types.mod cell_types.mod force_field_kind_types.mod colvar_types.mod molecule_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod ewald_environment_types.mod input_section_types.mod molecule_kind_types.mod pair_potential_types.mod shell_potential_types.mod force_field_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod string_utilities.mod memory_utilities.mod force_fields_all.mod base_hooks.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/force_fields_util.F force_fields_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:01:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_fields_util.mod' due to: force_fields_util.o /build/reproducible-path/cp2k-8.1/src/force_fields_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod force_field_kind_types.mod pair_potential_types.mod force_field_types.mod particle_types.mod molecule_kind_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod colvar_types.mod ewald_environment_types.mod molecule_types.mod string_utilities.mod kinds.mod cp_output_handling.mod force_fields_all.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint_fxd.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint_fxd.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_kind_list_types.mod molecule_types.mod atomic_kind_types.mod particle_types.mod cp_subsys_types.mod colvar_types.mod particle_list_types.mod force_env_types.mod cell_types.mod atomic_kind_list_types.mod distribution_1d_types.mod message_passing.mod base_hooks.mod util.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/constraint_fxd.F constraint_fxd.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:01:32 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_fxd.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_fxd.F90 -/build/reproducible-path/cp2k-8.1/src/constraint_fxd.F:241:86: - - 241 | shell_particle_set(shell_index)%f(:) = force(:, natom + shell_index) - | ^ -Warning: 'shell_particle_set.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/constraint_fxd.F:241:86: Warning: 'shell_particle_set.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/constraint_fxd.F:241:86: Warning: 'shell_particle_set.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/constraint_fxd.F:240:75: - - 240 | core_particle_set(shell_index)%f(:) = force(:, iparticle) - | ^ -Warning: 'core_particle_set.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/constraint_fxd.F:240:75: Warning: 'core_particle_set.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/constraint_fxd.F:240:75: Warning: 'core_particle_set.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint_fxd.mod' due to: constraint_fxd.o /build/reproducible-path/cp2k-8.1/src/constraint_fxd.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_kind_list_types.mod molecule_types.mod atomic_kind_types.mod particle_types.mod cp_subsys_types.mod colvar_types.mod particle_list_types.mod force_env_types.mod cell_types.mod atomic_kind_list_types.mod distribution_1d_types.mod message_passing.mod base_hooks.mod util.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_result_methods.mod' due to: cp_result_methods.o +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:11:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_fields_util.mod' due to: force_fields_util.o /build/reproducible-path/cp2k-8.1/src/force_fields_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod particle_types.mod cell_types.mod force_field_kind_types.mod colvar_types.mod molecule_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod ewald_environment_types.mod input_section_types.mod molecule_kind_types.mod pair_potential_types.mod shell_potential_types.mod force_field_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod string_utilities.mod memory_utilities.mod force_fields_all.mod base_hooks.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_environment_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_environment_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mixed_energy_types.mod input_section_types.mod cp_result_types.mod virial_types.mod particle_list_types.mod base_hooks.mod cp_result_methods.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_environment_utils.F mixed_environment_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:01:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_environment_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_environment_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_environment_utils.mod' due to: mixed_environment_utils.o /build/reproducible-path/cp2k-8.1/src/mixed_environment_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mixed_energy_types.mod input_section_types.mod cp_result_types.mod virial_types.mod particle_list_types.mod base_hooks.mod cp_result_methods.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'colvar_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/colvar_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod mixed_energy_types.mod cell_types.mod input_enumeration_types.mod wannier_states_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod input_section_types.mod colvar_types.mod cp_parser_types.mod input_cp2k_colvar.mod input_constants.mod string_utilities.mod mathconstants.mod force_fields_util.mod constraint_fxd.mod kinds.mod kahan_sum.mod spherical_harmonics.mod cp_output_handling.mod mixed_environment_utils.mod cp_parser_methods.mod message_passing.mod fparser.mod memory_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod rmsd.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'colvar_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/colvar_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod cell_types.mod cp_parser_types.mod input_enumeration_types.mod force_env_types.mod colvar_types.mod particle_list_types.mod input_keyword_types.mod qs_environment_types.mod mixed_energy_types.mod wannier_states_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod mixed_environment_utils.mod spherical_harmonics.mod cp_output_handling.mod message_passing.mod kahan_sum.mod string_utilities.mod constraint_fxd.mod memory_utilities.mod rmsd.mod mathlib.mod base_hooks.mod mathconstants.mod force_fields_util.mod fparser.mod input_constants.mod input_cp2k_colvar.mod cp_parser_methods.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/colvar_methods.F colvar_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:01:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"colvar_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' colvar_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:11:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"colvar_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' colvar_methods.F90 /build/reproducible-path/cp2k-8.1/src/colvar_methods.F:1278:70: 1278 | tag_comp = enum_i2c(enum, colvar%xyz_diag_param%component) @@ -5906,99 +5926,79 @@ 2936 | REAL(dp) :: angle, cosine, dedphi, dedxia, dedxib, dedxic, dedxid, dedxt, dedxu, dedyia, & | ^ Warning: 'dedxia' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'colvar_methods.mod' due to: colvar_methods.o /build/reproducible-path/cp2k-8.1/src/colvar_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod mixed_energy_types.mod cell_types.mod input_enumeration_types.mod wannier_states_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod input_section_types.mod colvar_types.mod cp_parser_types.mod input_cp2k_colvar.mod input_constants.mod string_utilities.mod mathconstants.mod force_fields_util.mod constraint_fxd.mod kinds.mod kahan_sum.mod spherical_harmonics.mod cp_output_handling.mod mixed_environment_utils.mod cp_parser_methods.mod message_passing.mod fparser.mod memory_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod rmsd.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'colvar_methods.mod' due to: colvar_methods.o /build/reproducible-path/cp2k-8.1/src/colvar_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod cell_types.mod cp_parser_types.mod input_enumeration_types.mod force_env_types.mod colvar_types.mod particle_list_types.mod input_keyword_types.mod qs_environment_types.mod mixed_energy_types.mod wannier_states_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod mixed_environment_utils.mod spherical_harmonics.mod cp_output_handling.mod message_passing.mod kahan_sum.mod string_utilities.mod constraint_fxd.mod memory_utilities.mod rmsd.mod mathlib.mod base_hooks.mod mathconstants.mod force_fields_util.mod fparser.mod input_constants.mod input_cp2k_colvar.mod cp_parser_methods.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'colvar_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/colvar_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod cell_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod molecule_list_types.mod colvar_types.mod molecule_types.mod input_constants.mod string_utilities.mod util.mod kinds.mod message_passing.mod memory_utilities.mod mathlib.mod base_hooks.mod rmsd.mod colvar_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'colvar_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/colvar_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod particle_types.mod cell_types.mod force_env_types.mod colvar_types.mod molecule_types.mod particle_list_types.mod molecule_kind_list_types.mod distribution_1d_types.mod molecule_kind_types.mod molecule_list_types.mod kinds.mod message_passing.mod string_utilities.mod memory_utilities.mod rmsd.mod mathlib.mod util.mod base_hooks.mod input_constants.mod colvar_methods.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/colvar_utils.F colvar_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"colvar_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' colvar_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'colvar_utils.mod' due to: colvar_utils.o /build/reproducible-path/cp2k-8.1/src/colvar_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod cell_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod molecule_list_types.mod colvar_types.mod molecule_types.mod input_constants.mod string_utilities.mod util.mod kinds.mod message_passing.mod memory_utilities.mod mathlib.mod base_hooks.mod rmsd.mod colvar_methods.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:12:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"colvar_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' colvar_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'colvar_utils.mod' due to: colvar_utils.o /build/reproducible-path/cp2k-8.1/src/colvar_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod particle_types.mod cell_types.mod force_env_types.mod colvar_types.mod molecule_types.mod particle_list_types.mod molecule_kind_list_types.mod distribution_1d_types.mod molecule_kind_types.mod molecule_list_types.mod kinds.mod message_passing.mod string_utilities.mod memory_utilities.mod rmsd.mod mathlib.mod util.mod base_hooks.mod input_constants.mod colvar_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'averages_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/averages_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod virial_types.mod md_ener_types.mod force_env_types.mod cell_types.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod colvar_utils.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'averages_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/averages_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cell_types.mod md_ener_types.mod force_env_types.mod virial_types.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod colvar_utils.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/averages_types.F averages_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/averages_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' averages_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'averages_types.mod' due to: averages_types.o /build/reproducible-path/cp2k-8.1/src/motion/averages_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod virial_types.mod md_ener_types.mod force_env_types.mod cell_types.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod colvar_utils.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:12:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/averages_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' averages_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'averages_types.mod' due to: averages_types.o /build/reproducible-path/cp2k-8.1/src/motion/averages_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cell_types.mod md_ener_types.mod force_env_types.mod virial_types.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod colvar_utils.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'reftraj_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/reftraj_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod input_section_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/reftraj_types.F reftraj_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:12:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/reftraj_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' reftraj_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'reftraj_types.mod' due to: reftraj_types.o /build/reproducible-path/cp2k-8.1/src/motion/reftraj_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod input_section_types.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 free_energy_types.mod cp_para_types.mod barostat_types.mod extended_system_types.mod input_section_types.mod thermostat_types.mod simpar_types.mod thermal_region_types.mod md_ener_types.mod force_env_types.mod cell_types.mod reftraj_types.mod averages_types.mod input_constants.mod base_hooks.mod cp_para_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'free_energy_types.o' due to: /build/reproducible-path/cp2k-8.1/src/free_energy_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod input_constants.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/free_energy_types.F free_energy_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:12:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"free_energy_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' free_energy_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'free_energy_types.mod' due to: free_energy_types.o /build/reproducible-path/cp2k-8.1/src/free_energy_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod input_constants.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'thermal_region_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermal_region_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermal_region_types.F thermal_region_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:12:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermal_region_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermal_region_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'thermal_region_types.mod' due to: thermal_region_types.o /build/reproducible-path/cp2k-8.1/src/motion/thermal_region_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod input_section_types.mod barostat_types.mod averages_types.mod simpar_types.mod reftraj_types.mod thermostat_types.mod free_energy_types.mod cell_types.mod md_ener_types.mod force_env_types.mod thermal_region_types.mod kinds.mod input_constants.mod cp_para_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/md_environment_types.F md_environment_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_environment_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_environment_types.mod' due to: md_environment_types.o /build/reproducible-path/cp2k-8.1/src/motion/md_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 free_energy_types.mod cp_para_types.mod barostat_types.mod extended_system_types.mod input_section_types.mod thermostat_types.mod simpar_types.mod thermal_region_types.mod md_ener_types.mod force_env_types.mod cell_types.mod reftraj_types.mod averages_types.mod input_constants.mod base_hooks.mod cp_para_env.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:13:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_environment_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_environment_types.mod' due to: md_environment_types.o /build/reproducible-path/cp2k-8.1/src/motion/md_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod input_section_types.mod barostat_types.mod averages_types.mod simpar_types.mod reftraj_types.mod thermostat_types.mod free_energy_types.mod cell_types.mod md_ener_types.mod force_env_types.mod thermal_region_types.mod kinds.mod input_constants.mod cp_para_env.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'wiener_process.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/wiener_process.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod metadynamics_types.mod cp_subsys_types.mod simpar_types.mod parallel_rng_types.mod particle_list_types.mod force_env_types.mod md_environment_types.mod atomic_kind_list_types.mod distribution_1d_types.mod string_utilities.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'wiener_process.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/wiener_process.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod cp_subsys_types.mod input_section_types.mod metadynamics_types.mod particle_list_types.mod md_environment_types.mod simpar_types.mod atomic_kind_list_types.mod distribution_1d_types.mod force_env_types.mod kinds.mod string_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/wiener_process.F wiener_process.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/wiener_process.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' wiener_process.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'header.o' due to: /build/reproducible-path/cp2k-8.1/src/header.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp2k_info.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/header.F header.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"header.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' header.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'header.mod' due to: header.o /build/reproducible-path/cp2k-8.1/src/header.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp2k_info.mod kinds.mod base_hooks.mod -true +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:13:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/wiener_process.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' wiener_process.F90 /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'graphcon.o' due to: /build/reproducible-path/cp2k-8.1/src/graphcon.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 util.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/graphcon.F graphcon.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"graphcon.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' graphcon.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:13:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"graphcon.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' graphcon.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'graphcon.mod' due to: graphcon.o /build/reproducible-path/cp2k-8.1/src/graphcon.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 util.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mm_mapping_library.o' due to: /build/reproducible-path/cp2k-8.1/src/mm_mapping_library.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mm_mapping_library.o' due to: /build/reproducible-path/cp2k-8.1/src/mm_mapping_library.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mm_mapping_library.F mm_mapping_library.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mm_mapping_library.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mm_mapping_library.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mm_mapping_library.mod' due to: mm_mapping_library.o /build/reproducible-path/cp2k-8.1/src/mm_mapping_library.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:13:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mm_mapping_library.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mm_mapping_library.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mm_mapping_library.mod' due to: mm_mapping_library.o /build/reproducible-path/cp2k-8.1/src/mm_mapping_library.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_util.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qmmm_types_low.mod topology_types.mod string_utilities.mod periodic_table.mod cp_log_handling.mod base_hooks.mod graphcon.mod mm_mapping_library.mod string_table.mod cp_output_handling.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_util.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod topology_types.mod input_section_types.mod util.mod cp_log_handling.mod kinds.mod string_table.mod graphcon.mod cp_output_handling.mod mm_mapping_library.mod string_utilities.mod periodic_table.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_util.F topology_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:13:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_util.F90 /build/reproducible-path/cp2k-8.1/src/topology_util.F:977:61: 977 | upper_sym_1 = id2str(atom_info%id_element(iatom)) | 1 Warning: CHARACTER expression will be truncated in assignment (2/80) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_util.mod' due to: topology_util.o /build/reproducible-path/cp2k-8.1/src/topology_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qmmm_types_low.mod topology_types.mod string_utilities.mod periodic_table.mod cp_log_handling.mod base_hooks.mod graphcon.mod mm_mapping_library.mod string_table.mod cp_output_handling.mod util.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_xtl.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_xtl.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cell_types.mod cp_parser_types.mod cell_methods.mod cp_log_handling.mod mathlib.mod base_hooks.mod cp_output_handling.mod memory_utilities.mod string_table.mod kinds.mod cp_units.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_xtl.F topology_xtl.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_xtl.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_xtl.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_xtl.mod' due to: topology_xtl.o /build/reproducible-path/cp2k-8.1/src/topology_xtl.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cell_types.mod cp_parser_types.mod cell_methods.mod cp_log_handling.mod mathlib.mod base_hooks.mod cp_output_handling.mod memory_utilities.mod string_table.mod kinds.mod cp_units.mod cp_parser_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_input.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod colvar_types.mod topology_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_input.F topology_input.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_input.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_input.mod' due to: topology_input.o /build/reproducible-path/cp2k-8.1/src/topology_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod colvar_types.mod topology_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod kinds.mod memory_utilities.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_fields_input.o' due to: /build/reproducible-path/cp2k-8.1/src/force_fields_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod shell_potential_types.mod force_field_kind_types.mod cp_para_types.mod pair_potential_types.mod force_field_types.mod damping_dipole_types.mod input_section_types.mod cp_parser_types.mod string_utilities.mod mathconstants.mod force_fields_util.mod kinds.mod cp_output_handling.mod cp_linked_list_input.mod cp_parser_methods.mod bibliography.mod memory_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/force_fields_input.F force_fields_input.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields_input.F90 -/build/reproducible-path/cp2k-8.1/src/force_fields_input.F:1289:71: - - 1289 | nonbonded%pot(start + isec)%pot%set(1)%gal%met1 = atm_names(1) - | 1 -Warning: CHARACTER expression will be truncated in assignment (2/80) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/src/force_fields_input.F:1290:71: - - 1290 | nonbonded%pot(start + isec)%pot%set(1)%gal%met2 = atm_names(2) - | 1 -Warning: CHARACTER expression will be truncated in assignment (2/80) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_fields_input.mod' due to: force_fields_input.o /build/reproducible-path/cp2k-8.1/src/force_fields_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod shell_potential_types.mod force_field_kind_types.mod cp_para_types.mod pair_potential_types.mod force_field_types.mod damping_dipole_types.mod input_section_types.mod cp_parser_types.mod string_utilities.mod mathconstants.mod force_fields_util.mod kinds.mod cp_output_handling.mod cp_linked_list_input.mod cp_parser_methods.mod bibliography.mod memory_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_util.mod' due to: topology_util.o /build/reproducible-path/cp2k-8.1/src/topology_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod topology_types.mod input_section_types.mod util.mod cp_log_handling.mod kinds.mod string_table.mod graphcon.mod cp_output_handling.mod mm_mapping_library.mod string_utilities.mod periodic_table.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_psf.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_psf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cp_parser_types.mod input_constants.mod string_utilities.mod cp_log_handling.mod base_hooks.mod force_fields_input.mod memory_utilities.mod qmmm_ff_fist.mod topology_util.mod util.mod string_table.mod cp_output_handling.mod kinds.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_psf.F topology_psf.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_psf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_psf.F90 -/build/reproducible-path/cp2k-8.1/src/topology_psf.F:780:81: - - 780 | extension=".psf", my_local=.FALSE.) - | 1 -Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_psf.mod' due to: topology_psf.o /build/reproducible-path/cp2k-8.1/src/topology_psf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cp_parser_types.mod input_constants.mod string_utilities.mod cp_log_handling.mod base_hooks.mod force_fields_input.mod memory_utilities.mod qmmm_ff_fist.mod topology_util.mod util.mod string_table.mod cp_output_handling.mod kinds.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_coordinate_util.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_coordinate_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod exclusion_types.mod qmmm_types_low.mod external_potential_types.mod particle_types.mod topology_types.mod input_section_types.mod molecule_kind_types.mod atomic_kind_types.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod physcon.mod topology_util.mod string_table.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_coordinate_util.F topology_coordinate_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:13:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_coordinate_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_coordinate_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_coordinate_util.mod' due to: topology_coordinate_util.o /build/reproducible-path/cp2k-8.1/src/topology_coordinate_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod exclusion_types.mod qmmm_types_low.mod external_potential_types.mod particle_types.mod topology_types.mod input_section_types.mod molecule_kind_types.mod atomic_kind_types.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod physcon.mod topology_util.mod string_table.mod memory_utilities.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'subcell_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subcell_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod util.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'subcell_types.o' due to: /build/reproducible-path/cp2k-8.1/src/subcell_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod base_hooks.mod util.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/subcell_types.F subcell_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subcell_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' subcell_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'subcell_types.mod' due to: subcell_types.o /build/reproducible-path/cp2k-8.1/src/subcell_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod util.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:13:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"subcell_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' subcell_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'subcell_types.mod' due to: subcell_types.o /build/reproducible-path/cp2k-8.1/src/subcell_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod base_hooks.mod util.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_neighbor_lists.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_neighbor_lists.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod particle_types.mod subcell_types.mod fist_neighbor_list_types.mod exclusion_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod string_utilities.mod util.mod kinds.mod qmmm_ff_fist.mod cp_output_handling.mod memory_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_neighbor_lists.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_neighbor_lists.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod exclusion_types.mod atomic_kind_types.mod distribution_1d_types.mod input_section_types.mod subcell_types.mod fist_neighbor_list_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qmmm_ff_fist.mod string_utilities.mod memory_utilities.mod mathlib.mod util.mod base_hooks.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_neighbor_lists.F fist_neighbor_lists.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_neighbor_lists.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_neighbor_lists.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_neighbor_lists.mod' due to: fist_neighbor_lists.o /build/reproducible-path/cp2k-8.1/src/fist_neighbor_lists.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod particle_types.mod subcell_types.mod fist_neighbor_list_types.mod exclusion_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod string_utilities.mod util.mod kinds.mod qmmm_ff_fist.mod cp_output_handling.mod memory_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_units.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:13:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_neighbor_lists.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_neighbor_lists.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_neighbor_lists.mod' due to: fist_neighbor_lists.o /build/reproducible-path/cp2k-8.1/src/fist_neighbor_lists.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod exclusion_types.mod atomic_kind_types.mod distribution_1d_types.mod input_section_types.mod subcell_types.mod fist_neighbor_list_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qmmm_ff_fist.mod string_utilities.mod memory_utilities.mod mathlib.mod util.mod base_hooks.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_generate_util.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_generate_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod particle_types.mod fist_neighbor_list_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod topology_types.mod input_constants.mod string_utilities.mod fist_neighbor_lists.mod topology_util.mod util.mod kinds.mod string_table.mod cp_output_handling.mod memory_utilities.mod periodic_table.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_generate_util.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_generate_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod topology_types.mod atomic_kind_types.mod input_section_types.mod fist_neighbor_list_types.mod fist_neighbor_lists.mod cp_log_handling.mod kinds.mod cp_output_handling.mod periodic_table.mod topology_util.mod string_utilities.mod memory_utilities.mod mathlib.mod util.mod string_table.mod base_hooks.mod input_constants.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_generate_util.F topology_generate_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:02:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_generate_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_generate_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:13:56 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_generate_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_generate_util.F90 /build/reproducible-path/cp2k-8.1/src/topology_generate_util.F:1897:59: 1897 | atm_symbol = id2str(atom_info%id_element(i)) @@ -6031,41 +6031,61 @@ 498 | atom_info%map_mol_typ(ilast + 1), atom_info%map_mol_num(ilast + 1)) | ^ Warning: 'ilast' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_generate_util.mod' due to: topology_generate_util.o /build/reproducible-path/cp2k-8.1/src/topology_generate_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod particle_types.mod fist_neighbor_list_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod topology_types.mod input_constants.mod string_utilities.mod fist_neighbor_lists.mod topology_util.mod util.mod kinds.mod string_table.mod cp_output_handling.mod memory_utilities.mod periodic_table.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_generate_util.mod' due to: topology_generate_util.o /build/reproducible-path/cp2k-8.1/src/topology_generate_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod topology_types.mod atomic_kind_types.mod input_section_types.mod fist_neighbor_list_types.mod fist_neighbor_lists.mod cp_log_handling.mod kinds.mod cp_output_handling.mod periodic_table.mod topology_util.mod string_utilities.mod memory_utilities.mod mathlib.mod util.mod string_table.mod base_hooks.mod input_constants.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_restarts_util.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_restarts_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod particle_list_types.mod input_section_types.mod cp_linked_list_input.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_restarts_util.F input_cp2k_restarts_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:14:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_restarts_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_restarts_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_restarts_util.mod' due to: input_cp2k_restarts_util.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_restarts_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod particle_list_types.mod input_section_types.mod cp_linked_list_input.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_amber.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_amber.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cp_parser_types.mod force_field_types.mod topology_types.mod input_section_types.mod util.mod cp_log_handling.mod kinds.mod base_hooks.mod string_table.mod topology_generate_util.mod cp_output_handling.mod memory_utilities.mod input_cp2k_restarts_util.mod qmmm_ff_fist.mod cp_parser_methods.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_amber.F topology_amber.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:14:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_amber.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_amber.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_amber.mod' due to: topology_amber.o /build/reproducible-path/cp2k-8.1/src/topology_amber.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cp_parser_types.mod force_field_types.mod topology_types.mod input_section_types.mod util.mod cp_log_handling.mod kinds.mod base_hooks.mod string_table.mod topology_generate_util.mod cp_output_handling.mod memory_utilities.mod input_cp2k_restarts_util.mod qmmm_ff_fist.mod cp_parser_methods.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_topology_util.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_topology_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod qmmm_types_low.mod topology_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod string_utilities.mod string_table.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_topology_util.F qmmm_topology_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:14:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_topology_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_topology_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_topology_util.mod' due to: qmmm_topology_util.o /build/reproducible-path/cp2k-8.1/src/qmmm_topology_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod qmmm_types_low.mod topology_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod string_utilities.mod string_table.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_pdb.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_pdb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cell_types.mod cp_parser_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp2k_info.mod cp_output_handling.mod memory_utilities.mod physcon.mod qmmm_ff_fist.mod string_table.mod kinds.mod cp_units.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_pdb.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_pdb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod cell_types.mod cp_parser_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod physcon.mod cp_output_handling.mod memory_utilities.mod qmmm_ff_fist.mod string_table.mod cp2k_info.mod cp_parser_methods.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_pdb.F topology_pdb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:03:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_pdb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_pdb.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:14:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_pdb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_pdb.F90 /build/reproducible-path/cp2k-8.1/src/topology_pdb.F:317:63: 317 | my_local=.FALSE.) | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_pdb.mod' due to: topology_pdb.o /build/reproducible-path/cp2k-8.1/src/topology_pdb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cell_types.mod cp_parser_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp2k_info.mod cp_output_handling.mod memory_utilities.mod physcon.mod qmmm_ff_fist.mod string_table.mod kinds.mod cp_units.mod cp_parser_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_restarts_util.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_restarts_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod particle_list_types.mod base_hooks.mod cp_linked_list_input.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_restarts_util.F input_cp2k_restarts_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:03:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_restarts_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_restarts_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_restarts_util.mod' due to: input_cp2k_restarts_util.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_restarts_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod particle_list_types.mod base_hooks.mod cp_linked_list_input.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_pdb.mod' due to: topology_pdb.o /build/reproducible-path/cp2k-8.1/src/topology_pdb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod cell_types.mod cp_parser_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod physcon.mod cp_output_handling.mod memory_utilities.mod qmmm_ff_fist.mod string_table.mod cp2k_info.mod cp_parser_methods.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_gromos.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_gromos.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cp_parser_types.mod cp_log_handling.mod base_hooks.mod memory_utilities.mod input_cp2k_restarts_util.mod string_table.mod cp_output_handling.mod kinds.mod cp_units.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_gromos.F topology_gromos.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:03:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_gromos.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_gromos.F90 -/build/reproducible-path/cp2k-8.1/src/topology_gromos.F:280:21: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_fields_input.o' due to: /build/reproducible-path/cp2k-8.1/src/force_fields_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod force_field_kind_types.mod damping_dipole_types.mod input_val_types.mod input_section_types.mod pair_potential_types.mod shell_potential_types.mod force_field_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod bibliography.mod string_utilities.mod memory_utilities.mod mathlib.mod base_hooks.mod mathconstants.mod cp_linked_list_input.mod force_fields_util.mod cp_parser_methods.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/force_fields_input.F force_fields_input.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:14:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields_input.F90 +/build/reproducible-path/cp2k-8.1/src/force_fields_input.F:1289:71: - 280 | nsolute = natom - | ^ -Warning: 'natom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_gromos.mod' due to: topology_gromos.o /build/reproducible-path/cp2k-8.1/src/topology_gromos.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cp_parser_types.mod cp_log_handling.mod base_hooks.mod memory_utilities.mod input_cp2k_restarts_util.mod string_table.mod cp_output_handling.mod kinds.mod cp_units.mod cp_parser_methods.mod + 1289 | nonbonded%pot(start + isec)%pot%set(1)%gal%met1 = atm_names(1) + | 1 +Warning: CHARACTER expression will be truncated in assignment (2/80) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/src/force_fields_input.F:1290:71: + + 1290 | nonbonded%pot(start + isec)%pot%set(1)%gal%met2 = atm_names(2) + | 1 +Warning: CHARACTER expression will be truncated in assignment (2/80) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_fields_input.mod' due to: force_fields_input.o /build/reproducible-path/cp2k-8.1/src/force_fields_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod force_field_kind_types.mod damping_dipole_types.mod input_val_types.mod input_section_types.mod pair_potential_types.mod shell_potential_types.mod force_field_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod bibliography.mod string_utilities.mod memory_utilities.mod mathlib.mod base_hooks.mod mathconstants.mod cp_linked_list_input.mod force_fields_util.mod cp_parser_methods.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_topology_util.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_topology_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod input_section_types.mod qmmm_types_low.mod topology_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod string_table.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_topology_util.F qmmm_topology_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:03:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_topology_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_topology_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_topology_util.mod' due to: qmmm_topology_util.o /build/reproducible-path/cp2k-8.1/src/qmmm_topology_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod input_section_types.mod qmmm_types_low.mod topology_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod string_table.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_psf.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_psf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod topology_types.mod input_section_types.mod util.mod cp_log_handling.mod kinds.mod input_constants.mod topology_util.mod cp_output_handling.mod memory_utilities.mod force_fields_input.mod qmmm_ff_fist.mod string_utilities.mod string_table.mod cp_parser_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_psf.F topology_psf.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:15:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_psf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_psf.F90 +/build/reproducible-path/cp2k-8.1/src/topology_psf.F:780:81: + + 780 | extension=".psf", my_local=.FALSE.) + | 1 +Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_psf.mod' due to: topology_psf.o /build/reproducible-path/cp2k-8.1/src/topology_psf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod topology_types.mod input_section_types.mod util.mod cp_log_handling.mod kinds.mod input_constants.mod topology_util.mod cp_output_handling.mod memory_utilities.mod force_fields_input.mod qmmm_ff_fist.mod string_utilities.mod string_table.mod cp_parser_methods.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_constraint_util.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_constraint_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod input_section_types.mod colvar_types.mod qmmm_types_low.mod topology_types.mod cell_types.mod particle_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod qmmm_ff_fist.mod colvar_utils.mod colvar_methods.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_constraint_util.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_constraint_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod molecule_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod topology_types.mod colvar_types.mod molecule_kind_types.mod atomic_kind_types.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod colvar_methods.mod qmmm_ff_fist.mod colvar_utils.mod memory_utilities.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_constraint_util.F topology_constraint_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:03:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_constraint_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_constraint_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:15:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_constraint_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_constraint_util.F90 /build/reproducible-path/cp2k-8.1/src/topology_constraint_util.F:751:96: 751 | fixd_list(kk)%restraint%active = cons_info%fixed_mol_restraint(k1loc) @@ -6076,35130 +6096,34991 @@ 101 | INTEGER :: cind, first, first_atom, gind, handle, handle2, i, ii, itype, iw, j, k, k1loc, & | ^ Warning: 'itype' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_constraint_util.mod' due to: topology_constraint_util.o /build/reproducible-path/cp2k-8.1/src/topology_constraint_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod input_section_types.mod colvar_types.mod qmmm_types_low.mod topology_types.mod cell_types.mod particle_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod qmmm_ff_fist.mod colvar_utils.mod colvar_methods.mod kinds.mod memory_utilities.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_multiple_unit_cell.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_multiple_unit_cell.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod topology_types.mod cell_types.mod base_hooks.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_multiple_unit_cell.F topology_multiple_unit_cell.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:03:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_multiple_unit_cell.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_multiple_unit_cell.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_multiple_unit_cell.mod' due to: topology_multiple_unit_cell.o /build/reproducible-path/cp2k-8.1/src/topology_multiple_unit_cell.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod topology_types.mod cell_types.mod base_hooks.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_constraint_util.mod' due to: topology_constraint_util.o /build/reproducible-path/cp2k-8.1/src/topology_constraint_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod molecule_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod topology_types.mod colvar_types.mod molecule_kind_types.mod atomic_kind_types.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod colvar_methods.mod qmmm_ff_fist.mod colvar_utils.mod memory_utilities.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_xyz.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_xyz.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cp_parser_types.mod periodic_table.mod cp_log_handling.mod base_hooks.mod memory_utilities.mod string_table.mod cp_output_handling.mod kinds.mod cp_units.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_xyz.F topology_xyz.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:03:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_xyz.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_xyz.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_xyz.mod' due to: topology_xyz.o /build/reproducible-path/cp2k-8.1/src/topology_xyz.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cp_parser_types.mod periodic_table.mod cp_log_handling.mod base_hooks.mod memory_utilities.mod string_table.mod cp_output_handling.mod kinds.mod cp_units.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_cp2k.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_cp2k.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod cell_types.mod cp_parser_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod string_table.mod cp_output_handling.mod memory_utilities.mod periodic_table.mod cp_parser_methods.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_cp2k.F topology_cp2k.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:15:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_cp2k.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_cp2k.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_cp2k.mod' due to: topology_cp2k.o /build/reproducible-path/cp2k-8.1/src/topology_cp2k.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod cell_types.mod cp_parser_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod string_table.mod cp_output_handling.mod memory_utilities.mod periodic_table.mod cp_parser_methods.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_cif.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_cif.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cell_types.mod cp_parser_types.mod string_utilities.mod cell_methods.mod cp_log_handling.mod base_hooks.mod fparser.mod cp_output_handling.mod memory_utilities.mod string_table.mod kinds.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_cif.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_cif.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod cell_types.mod cp_parser_types.mod input_section_types.mod cp_log_handling.mod kinds.mod fparser.mod cell_methods.mod cp_output_handling.mod memory_utilities.mod string_utilities.mod string_table.mod cp_parser_methods.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_cif.F topology_cif.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:03:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_cif.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_cif.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_cif.mod' due to: topology_cif.o /build/reproducible-path/cp2k-8.1/src/topology_cif.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cell_types.mod cp_parser_types.mod string_utilities.mod cell_methods.mod cp_log_handling.mod base_hooks.mod fparser.mod cp_output_handling.mod memory_utilities.mod string_table.mod kinds.mod cp_parser_methods.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:15:29 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_cif.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_cif.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_cif.mod' due to: topology_cif.o /build/reproducible-path/cp2k-8.1/src/topology_cif.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod cell_types.mod cp_parser_types.mod input_section_types.mod cp_log_handling.mod kinds.mod fparser.mod cell_methods.mod cp_output_handling.mod memory_utilities.mod string_utilities.mod string_table.mod cp_parser_methods.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_amber.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_amber.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod force_field_types.mod particle_types.mod cp_parser_types.mod cp_log_handling.mod topology_generate_util.mod base_hooks.mod util.mod memory_utilities.mod qmmm_ff_fist.mod input_cp2k_restarts_util.mod cp_output_handling.mod string_table.mod kinds.mod cp_units.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_amber.F topology_amber.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:03:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_amber.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_amber.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_amber.mod' due to: topology_amber.o /build/reproducible-path/cp2k-8.1/src/topology_amber.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod force_field_types.mod particle_types.mod cp_parser_types.mod cp_log_handling.mod topology_generate_util.mod base_hooks.mod util.mod memory_utilities.mod qmmm_ff_fist.mod input_cp2k_restarts_util.mod cp_output_handling.mod string_table.mod kinds.mod cp_units.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_input.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 topology_types.mod colvar_types.mod input_section_types.mod cp_log_handling.mod kinds.mod input_constants.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_input.F topology_input.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:15:32 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_input.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_input.mod' due to: topology_input.o /build/reproducible-path/cp2k-8.1/src/topology_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 topology_types.mod colvar_types.mod input_section_types.mod cp_log_handling.mod kinds.mod input_constants.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_cp2k.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_cp2k.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cell_types.mod cp_parser_types.mod periodic_table.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod memory_utilities.mod string_table.mod kinds.mod cp_units.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_cp2k.F topology_cp2k.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:03:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_cp2k.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_cp2k.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_cp2k.mod' due to: topology_cp2k.o /build/reproducible-path/cp2k-8.1/src/topology_cp2k.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod topology_types.mod cell_types.mod cp_parser_types.mod periodic_table.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod memory_utilities.mod string_table.mod kinds.mod cp_units.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_gromos.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_gromos.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod cp_parser_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod memory_utilities.mod input_cp2k_restarts_util.mod string_table.mod cp_parser_methods.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_gromos.F topology_gromos.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:15:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_gromos.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_gromos.F90 +/build/reproducible-path/cp2k-8.1/src/topology_gromos.F:280:21: + + 280 | nsolute = natom + | ^ +Warning: 'natom' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_gromos.mod' due to: topology_gromos.o /build/reproducible-path/cp2k-8.1/src/topology_gromos.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod cp_parser_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod memory_utilities.mod input_cp2k_restarts_util.mod string_table.mod cp_parser_methods.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_coordinate_util.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_coordinate_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod external_potential_types.mod topology_types.mod exclusion_types.mod particle_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod topology_util.mod string_table.mod cp_output_handling.mod physcon.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_coordinate_util.F topology_coordinate_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:03:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_coordinate_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_coordinate_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_coordinate_util.mod' due to: topology_coordinate_util.o /build/reproducible-path/cp2k-8.1/src/topology_coordinate_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod external_potential_types.mod topology_types.mod exclusion_types.mod particle_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod topology_util.mod string_table.mod cp_output_handling.mod physcon.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_xyz.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_xyz.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod cp_parser_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod string_table.mod cp_output_handling.mod memory_utilities.mod periodic_table.mod cp_parser_methods.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_xyz.F topology_xyz.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:15:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_xyz.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_xyz.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_xyz.mod' due to: topology_xyz.o /build/reproducible-path/cp2k-8.1/src/topology_xyz.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod cp_parser_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod string_table.mod cp_output_handling.mod memory_utilities.mod periodic_table.mod cp_parser_methods.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_multiple_unit_cell.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_multiple_unit_cell.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 topology_types.mod cell_types.mod input_section_types.mod kinds.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_multiple_unit_cell.F topology_multiple_unit_cell.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:15:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_multiple_unit_cell.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_multiple_unit_cell.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_multiple_unit_cell.mod' due to: topology_multiple_unit_cell.o /build/reproducible-path/cp2k-8.1/src/topology_multiple_unit_cell.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 topology_types.mod cell_types.mod input_section_types.mod kinds.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_connectivity_util.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_connectivity_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod force_field_kind_types.mod input_section_types.mod topology_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod string_table.mod cp_output_handling.mod util.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_connectivity_util.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_connectivity_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod topology_types.mod force_field_kind_types.mod input_section_types.mod molecule_kind_types.mod util.mod cp_log_handling.mod kinds.mod input_constants.mod cp_output_handling.mod string_table.mod memory_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_connectivity_util.F topology_connectivity_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:04:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_connectivity_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_connectivity_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_connectivity_util.mod' due to: topology_connectivity_util.o /build/reproducible-path/cp2k-8.1/src/topology_connectivity_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod force_field_kind_types.mod input_section_types.mod topology_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod string_table.mod cp_output_handling.mod util.mod kinds.mod memory_utilities.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:15:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_connectivity_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_connectivity_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_connectivity_util.mod' due to: topology_connectivity_util.o /build/reproducible-path/cp2k-8.1/src/topology_connectivity_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod topology_types.mod force_field_kind_types.mod input_section_types.mod molecule_kind_types.mod util.mod cp_log_handling.mod kinds.mod input_constants.mod cp_output_handling.mod string_table.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology.o' due to: /build/reproducible-path/cp2k-8.1/src/topology.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod exclusion_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod colvar_types.mod topology_types.mod molecule_types.mod input_constants.mod cell_methods.mod topology_xtl.mod topology_util.mod kinds.mod topology_input.mod topology_psf.mod topology_generate_util.mod topology_pdb.mod string_table.mod cp_output_handling.mod topology_gromos.mod qmmm_topology_util.mod topology_constraint_util.mod topology_multiple_unit_cell.mod topology_xyz.mod topology_cif.mod topology_amber.mod mm_mapping_library.mod topology_cp2k.mod topology_coordinate_util.mod input_cp2k_binary_restarts.mod cp_log_handling.mod base_hooks.mod atoms_input.mod colvar_utils.mod topology_connectivity_util.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology_xtl.o' due to: /build/reproducible-path/cp2k-8.1/src/topology_xtl.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod cell_types.mod cp_parser_types.mod input_section_types.mod mathlib.mod cp_log_handling.mod kinds.mod base_hooks.mod cell_methods.mod cp_output_handling.mod memory_utilities.mod string_table.mod cp_parser_methods.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology_xtl.F topology_xtl.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:16:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology_xtl.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology_xtl.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology_xtl.mod' due to: topology_xtl.o /build/reproducible-path/cp2k-8.1/src/topology_xtl.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod topology_types.mod cell_types.mod cp_parser_types.mod input_section_types.mod mathlib.mod cp_log_handling.mod kinds.mod base_hooks.mod cell_methods.mod cp_output_handling.mod memory_utilities.mod string_table.mod cp_parser_methods.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'topology.o' due to: /build/reproducible-path/cp2k-8.1/src/topology.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod topology_types.mod colvar_types.mod molecule_types.mod exclusion_types.mod atomic_kind_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod topology_amber.mod qmmm_topology_util.mod topology_pdb.mod topology_psf.mod topology_constraint_util.mod cell_methods.mod topology_util.mod topology_coordinate_util.mod topology_generate_util.mod atoms_input.mod topology_cp2k.mod topology_cif.mod mm_mapping_library.mod string_table.mod colvar_utils.mod topology_input.mod topology_gromos.mod base_hooks.mod topology_xyz.mod topology_multiple_unit_cell.mod input_constants.mod topology_connectivity_util.mod topology_xtl.mod input_cp2k_binary_restarts.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/topology.F topology.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:04:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology.mod' due to: topology.o /build/reproducible-path/cp2k-8.1/src/topology.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod exclusion_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod colvar_types.mod topology_types.mod molecule_types.mod input_constants.mod cell_methods.mod topology_xtl.mod topology_util.mod kinds.mod topology_input.mod topology_psf.mod topology_generate_util.mod topology_pdb.mod string_table.mod cp_output_handling.mod topology_gromos.mod qmmm_topology_util.mod topology_constraint_util.mod topology_multiple_unit_cell.mod topology_xyz.mod topology_cif.mod topology_amber.mod mm_mapping_library.mod topology_cp2k.mod topology_coordinate_util.mod input_cp2k_binary_restarts.mod cp_log_handling.mod base_hooks.mod atoms_input.mod colvar_utils.mod topology_connectivity_util.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:16:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"topology.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' topology.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'topology.mod' due to: topology.o /build/reproducible-path/cp2k-8.1/src/topology.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod topology_types.mod colvar_types.mod molecule_types.mod exclusion_types.mod atomic_kind_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod topology_amber.mod qmmm_topology_util.mod topology_pdb.mod topology_psf.mod topology_constraint_util.mod cell_methods.mod topology_util.mod topology_coordinate_util.mod topology_generate_util.mod atoms_input.mod topology_cp2k.mod topology_cif.mod mm_mapping_library.mod string_table.mod colvar_utils.mod topology_input.mod topology_gromos.mod base_hooks.mod topology_xyz.mod topology_multiple_unit_cell.mod input_constants.mod topology_connectivity_util.mod topology_xtl.mod input_cp2k_binary_restarts.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_subsys_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_subsys_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod virial_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod atprop_types.mod exclusion_types.mod particle_list_types.mod molecule_list_types.mod atomic_kind_types.mod cp_result_types.mod input_section_types.mod qmmm_types_low.mod topology_types.mod molecule_types.mod input_constants.mod topology_util.mod kinds.mod topology.mod string_table.mod cp_para_env.mod topology_coordinate_util.mod base_hooks.mod colvar_methods.mod topology_connectivity_util.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_subsys_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_subsys_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod qmmm_types_low.mod cp_result_types.mod particle_types.mod cell_types.mod topology_types.mod atprop_types.mod molecule_types.mod exclusion_types.mod particle_list_types.mod molecule_kind_list_types.mod atomic_kind_types.mod input_section_types.mod molecule_kind_types.mod virial_types.mod molecule_list_types.mod atomic_kind_list_types.mod kinds.mod topology_util.mod topology_coordinate_util.mod cp_para_env.mod topology.mod string_table.mod base_hooks.mod input_constants.mod colvar_methods.mod topology_connectivity_util.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_subsys_methods.F cp_subsys_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:04:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_subsys_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_subsys_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_subsys_methods.mod' due to: cp_subsys_methods.o /build/reproducible-path/cp2k-8.1/src/cp_subsys_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod virial_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod atprop_types.mod exclusion_types.mod particle_list_types.mod molecule_list_types.mod atomic_kind_types.mod cp_result_types.mod input_section_types.mod qmmm_types_low.mod topology_types.mod molecule_types.mod input_constants.mod topology_util.mod kinds.mod topology.mod string_table.mod cp_para_env.mod topology_coordinate_util.mod base_hooks.mod colvar_methods.mod topology_connectivity_util.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:16:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_subsys_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_subsys_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_subsys_methods.mod' due to: cp_subsys_methods.o /build/reproducible-path/cp2k-8.1/src/cp_subsys_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod qmmm_types_low.mod cp_result_types.mod particle_types.mod cell_types.mod topology_types.mod atprop_types.mod molecule_types.mod exclusion_types.mod particle_list_types.mod molecule_kind_list_types.mod atomic_kind_types.mod input_section_types.mod molecule_kind_types.mod virial_types.mod molecule_list_types.mod atomic_kind_list_types.mod kinds.mod topology_util.mod topology_coordinate_util.mod cp_para_env.mod topology.mod string_table.mod base_hooks.mod input_constants.mod colvar_methods.mod topology_connectivity_util.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_subsys_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_subsys_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod basis_set_types.mod atomic_kind_types.mod cp_para_types.mod input_section_types.mod qs_kind_types.mod qs_subsys_types.mod cp_subsys_types.mod external_potential_types.mod atom_types.mod cell_types.mod cell_methods.mod base_hooks.mod cp_subsys_methods.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_subsys_methods.F qs_subsys_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:04:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_subsys_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_subsys_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_subsys_methods.mod' due to: qs_subsys_methods.o /build/reproducible-path/cp2k-8.1/src/qs_subsys_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod basis_set_types.mod atomic_kind_types.mod cp_para_types.mod input_section_types.mod qs_kind_types.mod qs_subsys_types.mod cp_subsys_types.mod external_potential_types.mod atom_types.mod cell_types.mod cell_methods.mod base_hooks.mod cp_subsys_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_min_heap.mod' due to: cp_min_heap.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_gemm_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_gemm_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod input_constants.mod string_utilities.mod base_hooks.mod message_passing.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_gemm_interface.F cp_gemm_interface.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:04:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_gemm_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_gemm_interface.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_gemm_interface.mod' due to: cp_gemm_interface.o /build/reproducible-path/cp2k-8.1/src/cp_gemm_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod input_constants.mod string_utilities.mod base_hooks.mod message_passing.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'distribution_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/distribution_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod parallel_rng_types.mod molecule_types.mod atomic_kind_types.mod distribution_2d_types.mod basis_set_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_min_heap.mod message_passing.mod mathlib.mod util.mod cp_array_utils.mod cp_blacs_env.mod machine.mod base_hooks.mod mathconstants.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/distribution_methods.F distribution_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:16:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"distribution_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' distribution_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'distribution_methods.mod' due to: distribution_methods.o /build/reproducible-path/cp2k-8.1/src/distribution_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod parallel_rng_types.mod molecule_types.mod atomic_kind_types.mod distribution_2d_types.mod basis_set_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_min_heap.mod message_passing.mod mathlib.mod util.mod cp_array_utils.mod cp_blacs_env.mod machine.mod base_hooks.mod mathconstants.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eip_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/eip_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod molecule_types.mod eip_environment_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod cell_methods.mod particle_methods.mod cp_subsys_methods.mod distribution_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/eip_environment.F eip_environment.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:16:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eip_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eip_environment.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eip_environment.mod' due to: eip_environment.o /build/reproducible-path/cp2k-8.1/src/eip_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod molecule_types.mod eip_environment_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod cell_methods.mod particle_methods.mod cp_subsys_methods.mod distribution_methods.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_parsing.mod' due to: input_parsing.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_read.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_read.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod input_section_types.mod input_parsing.mod base_hooks.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_read.F input_cp2k_read.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:16:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_read.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_read.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_read.mod' due to: input_cp2k_read.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_read.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod input_section_types.mod input_parsing.mod base_hooks.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'spglib_f08.o' due to: /build/reproducible-path/cp2k-8.1/src/spglib_f08.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molsym.o' due to: /build/reproducible-path/cp2k-8.1/src/molsym.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathlib.mod base_hooks.mod mathconstants.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/molsym.F molsym.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:16:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molsym.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molsym.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molsym.mod' due to: molsym.o /build/reproducible-path/cp2k-8.1/src/molsym.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathlib.mod base_hooks.mod mathconstants.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'spglib_f08.o' due to: /build/reproducible-path/cp2k-8.1/src/spglib_f08.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/spglib_f08.F spglib_f08.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:04:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"spglib_f08.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' spglib_f08.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'spglib_f08.mod' due to: spglib_f08.o /build/reproducible-path/cp2k-8.1/src/spglib_f08.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:16:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"spglib_f08.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' spglib_f08.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'spglib_f08.mod' due to: spglib_f08.o /build/reproducible-path/cp2k-8.1/src/spglib_f08.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cryssym.o' due to: /build/reproducible-path/cp2k-8.1/src/cryssym.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 string_utilities.mod base_hooks.mod spglib_f08.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cryssym.o' due to: /build/reproducible-path/cp2k-8.1/src/cryssym.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 spglib_f08.mod kinds.mod string_utilities.mod bibliography.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cryssym.F cryssym.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:04:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cryssym.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cryssym.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cryssym.mod' due to: cryssym.o /build/reproducible-path/cp2k-8.1/src/cryssym.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 string_utilities.mod base_hooks.mod spglib_f08.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fermi_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/fermi_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod kahan_sum.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fermi_utils.F fermi_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:04:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fermi_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fermi_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fermi_utils.mod' due to: fermi_utils.o /build/reproducible-path/cp2k-8.1/src/fermi_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod kahan_sum.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:16:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cryssym.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cryssym.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cryssym.mod' due to: cryssym.o /build/reproducible-path/cp2k-8.1/src/cryssym.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 spglib_f08.mod kinds.mod string_utilities.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_cp2k_link.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cp2k_link.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod input_keyword_types.mod atomic_kind_types.mod input_section_types.mod qs_kind_types.mod qs_neighbor_list_types.mod cp_control_types.mod qs_ks_types.mod ao_util.mod string_utilities.mod qs_integral_utils.mod base_hooks.mod bibliography.mod cp_dbcsr_operations.mod orbital_pointers.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cp2k_link.F cp_dbcsr_cp2k_link.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:04:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_cp2k_link.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_cp2k_link.F90 -/build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cp2k_link.F:509:13: - - 509 | IF (jatom /= last_jatom) THEN - | ^ -Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_cp2k_link.mod' due to: cp_dbcsr_cp2k_link.o /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cp2k_link.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod input_keyword_types.mod atomic_kind_types.mod input_section_types.mod qs_kind_types.mod qs_neighbor_list_types.mod cp_control_types.mod qs_ks_types.mod ao_util.mod string_utilities.mod qs_integral_utils.mod base_hooks.mod bibliography.mod cp_dbcsr_operations.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_symmetry.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_symmetry.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod input_section_types.mod atomic_kind_types.mod molsym.mod cp_log_handling.mod kinds.mod cryssym.mod base_hooks.mod physcon.mod cp_output_handling.mod string_utilities.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_symmetry.F cp_symmetry.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:16:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_symmetry.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_symmetry.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_symmetry.mod' due to: cp_symmetry.o /build/reproducible-path/cp2k-8.1/src/cp_symmetry.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod input_section_types.mod atomic_kind_types.mod molsym.mod cp_log_handling.mod kinds.mod cryssym.mod base_hooks.mod physcon.mod cp_output_handling.mod string_utilities.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kpoint_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/kpoint_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_mo_types.mod cp_para_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_constants.mod cp_gemm_interface.mod mathconstants.mod cp_fm_struct.mod cp_blacs_env.mod qs_matrix_pools.mod kinds.mod util.mod cryssym.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod fermi_utils.mod cp_dbcsr_cp2k_link.mod cp_para_env.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kpoint_methods.F kpoint_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:04:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_methods.F90 -/build/reproducible-path/cp2k-8.1/src/kpoint_methods.F:342:26: - - 342 | nkp_grp = npe/ngr - | ^ -Warning: 'ngr' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kpoint_methods.mod' due to: kpoint_methods.o /build/reproducible-path/cp2k-8.1/src/kpoint_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_mo_types.mod cp_para_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_constants.mod cp_gemm_interface.mod mathconstants.mod cp_fm_struct.mod cp_blacs_env.mod qs_matrix_pools.mod kinds.mod util.mod cryssym.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod fermi_utils.mod cp_dbcsr_cp2k_link.mod cp_para_env.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_diag.mod' due to: cp_fm_diag.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_oce_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_oce_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod particle_types.mod qs_neighbor_list_types.mod paw_proj_set_types.mod sap_kind_types.mod block_p_types.mod ao_util.mod ai_overlap.mod base_hooks.mod mathconstants.mod orbital_pointers.mod orbital_transformation_matrices.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_oce_methods.F qs_oce_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:04:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_oce_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_oce_methods.F90 -/build/reproducible-path/cp2k-8.1/src/qs_oce_methods.F:84:58: - - 84 | maxder, maxlb, maxlprj, maxnprja, maxsoa, msab, n, ncob, np_car, np_sph, nsatbas, nseta, & - | ^ -Warning: 'n' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_oce_methods.F:548:40: - - 548 | clist%nsgf_cnt = nsgf_cnt - | ^ -Warning: 'nsgf_cnt' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_oce_methods.mod' due to: qs_oce_methods.o /build/reproducible-path/cp2k-8.1/src/qs_oce_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod particle_types.mod qs_neighbor_list_types.mod paw_proj_set_types.mod sap_kind_types.mod block_p_types.mod ao_util.mod ai_overlap.mod base_hooks.mod mathconstants.mod orbital_pointers.mod orbital_transformation_matrices.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_gemm_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_gemm_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod message_passing.mod kinds.mod base_hooks.mod input_constants.mod cp_dbcsr_operations.mod string_utilities.mod cp_fm_basic_linalg.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_gemm_interface.F cp_gemm_interface.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:16:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_gemm_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_gemm_interface.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_gemm_interface.mod' due to: cp_gemm_interface.o /build/reproducible-path/cp2k-8.1/src/cp_gemm_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod message_passing.mod kinds.mod base_hooks.mod input_constants.mod cp_dbcsr_operations.mod string_utilities.mod cp_fm_basic_linalg.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho0_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho0_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod basis_set_types.mod qs_rho0_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_local_rho_types.mod atomic_kind_types.mod input_section_types.mod mathconstants.mod kinds.mod qs_harmonics_atom.mod cp_output_handling.mod ao_util.mod qs_oce_methods.mod qs_grid_atom.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod orbital_transformation_matrices.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho0_methods.F qs_rho0_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:05:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho0_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho0_methods.F90 -/build/reproducible-path/cp2k-8.1/src/qs_rho0_methods.F:194:74: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dkh_main.o' due to: /build/reproducible-path/cp2k-8.1/src/dkh_main.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_fm_types.mod kinds.mod cp_fm_diag.mod cp_gemm_interface.mod cp_fm_cholesky.mod physcon.mod cp_blacs_env.mod cp_fm_struct.mod cp_fm_basic_linalg.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dkh_main.F dkh_main.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:16:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dkh_main.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dkh_main.F90 +/build/reproducible-path/cp2k-8.1/src/dkh_main.F:101:37: - 194 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: cpc_ah, cpc_as - | ^ -Warning: 'cpc_as.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_rho0_methods.F:194:66: + 101 | SUBROUTINE DKH_full_transformation(qs_env, matrix_s, matrix_v, matrix_t, matrix_pVp, n, dkh_order) + | ^ +Warning: 'dkh_full_transformation' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/dkh_main.F:746:20: - 194 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: cpc_ah, cpc_as - | ^ -Warning: 'cpc_ah.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho0_methods.mod' due to: qs_rho0_methods.o /build/reproducible-path/cp2k-8.1/src/qs_rho0_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod basis_set_types.mod qs_rho0_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_local_rho_types.mod atomic_kind_types.mod input_section_types.mod mathconstants.mod kinds.mod qs_harmonics_atom.mod cp_output_handling.mod ao_util.mod qs_oce_methods.mod qs_grid_atom.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod orbital_transformation_matrices.mod orbital_pointers.mod + 746 | SUBROUTINE even4a(n, ev4, e1, pe1p, vv, gg) + | ^ +Warning: 'even4a' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dkh_main.mod' due to: dkh_main.o /build/reproducible-path/cp2k-8.1/src/dkh_main.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_fm_types.mod kinds.mod cp_fm_diag.mod cp_gemm_interface.mod cp_fm_cholesky.mod physcon.mod cp_blacs_env.mod cp_fm_struct.mod cp_fm_basic_linalg.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'virial_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/virial_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod particle_types.mod virial_types.mod cp_subsys_types.mod particle_list_types.mod cell_types.mod atomic_kind_list_types.mod distribution_1d_types.mod mathlib.mod message_passing.mod base_hooks.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/virial_methods.F virial_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:05:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"virial_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' virial_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'virial_methods.mod' due to: virial_methods.o /build/reproducible-path/cp2k-8.1/src/virial_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod particle_types.mod virial_types.mod cp_subsys_types.mod particle_list_types.mod cell_types.mod atomic_kind_list_types.mod distribution_1d_types.mod mathlib.mod message_passing.mod base_hooks.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_operators.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_operators.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod mathlib.mod lapack.mod mathconstants.mod periodic_table.mod kinds.mod atom_utils.mod ai_onecenter.mod input_constants.mod physcon.mod dkh_main.mod qs_grid_atom.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_operators.F atom_operators.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:17:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_operators.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_operators.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_operators.mod' due to: atom_operators.o /build/reproducible-path/cp2k-8.1/src/atom_operators.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod mathlib.mod lapack.mod mathconstants.mod periodic_table.mod kinds.mod atom_utils.mod ai_onecenter.mod input_constants.mod physcon.mod dkh_main.mod qs_grid_atom.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dispersion_pairpot.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod qs_dispersion_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod particle_types.mod atprop_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod molecule_types.mod input_constants.mod mathconstants.mod cp_files.mod kinds.mod cp_output_handling.mod virial_methods.mod physcon.mod cp_parser_methods.mod message_passing.mod bibliography.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F qs_dispersion_pairpot.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:05:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dispersion_pairpot.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dispersion_pairpot.F90 -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1599:33: - - 1599 | e8tot = e8tot - e8 - | ^ -Warning: 'e8' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1598:33: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_pbe.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod xc_input_constants.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F xc_pbe.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:18:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_pbe.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_pbe.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1923:38: - 1598 | e6tot = e6tot - e6 - | ^ -Warning: 'e6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1617:53: + 1923 | t477 = 0.1e1_dp/t475*mu + | ^ +Warning: 'mu' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1524:25: - 1617 | fdij(:) = (de6 + de8)*rij(:)/dr*fac - | ^ -Warning: 'de8' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1617:53: Warning: 'de6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1789:117: + 1524 | kf_brhobrhob, mu + | ^ +note: 'mu' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1735:51: - 1789 | force(jkind)%dispersion(:, atom_b) = force(jkind)%dispersion(:, atom_b) + fdij(:) - | ^ -Warning: 'atom_b' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1788:117: + 1735 | Fx_b = 0.1e1_dp + kappa - kappa/t153 + | ^ +Warning: 'kappa' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1523:42: - 1788 | force(ikind)%dispersion(:, atom_a) = force(ikind)%dispersion(:, atom_a) - fdij(:) - | ^ -Warning: 'atom_a' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:2000:111: + 1523 | k_s1rhob, k_srhoa, k_srhob, kappa, kf_a, kf_arhoa, kf_arhoarhoa, kf_b, kf_brhob, & + | ^ +note: 'kappa' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1692:31: - 2000 | elrc9 = elrc9 - s9*64._dp*twopi*REAL(na*nb*nc, KIND=dp)*c9/(6._dp*rcut**3*cell%deth**2) - | ^ -Warning: 's9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1639:27: + 1692 | t101 = beta*t100 + | ^ +Warning: 'beta' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1512:24: - 1639 | ELSE IF (idmp == 2) THEN - | ^ -Warning: 'idmp' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:2102:10: + 1512 | Arhobrhob, beta, beta_1_1, beta_1_2, beta_1_3, beta_2_1, beta_2_2, beta_2_3, beta_3_1, & + | ^ +note: 'beta' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1108:55: - 2102 | IF (domol) THEN - | ^ -Warning: 'domol' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1545:83: + 1108 | t1385 = 0.1e1_dp/t1380*t469*mu*t101*s + | ^ +Warning: 'mu' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:431:24: - 1545 | CALL virial_pair_force(atstr(:, :, iatom), -0.5_dp, fdij, rij) - | ^ -Warning: 'atstr.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1545:83: Warning: 'atstr.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1819:101: + 431 | kfrhorhorho, mu, my_norm_drho, my_rho, p_1, p_2, rs, rs2rho, rsrho, rsrhorho, & + | ^ +note: 'mu' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1109:34: - 1819 | CALL virial_pair_force(atstr(:, :, katom), -0.5_dp, fdij, rca) - | ^ -Warning: 'atstr.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: + 1109 | t1386 = kappa**2 + | ^ +Warning: 'kappa' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:430:66: - 1219 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: atstr - | ^ -Warning: 'atstr.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: Warning: 'atstr.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: Warning: 'atstr.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: Warning: 'atstr.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: Warning: 'atstr.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1545:83: + 430 | k_s1rhorho, k_s2rho, k_srho, k_srho1rho, k_srhorho, kappa, kf, kf2rho, kfrho, kfrhorho, & + | ^ +note: 'kappa' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:956:34: - 1545 | CALL virial_pair_force(atstr(:, :, iatom), -0.5_dp, fdij, rij) - | ^ -Warning: 'atstr.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1550:68: + 956 | t879 = beta/t877 + | ^ +Warning: 'beta' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:423:25: - 1550 | atener(iatom) = atener(iatom) - 0.5_dp*xp*fdmp*fac - | ^ -Warning: 'atener.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1550:68: Warning: 'atener.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1550:68: Warning: 'atener.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dispersion_pairpot.mod' due to: qs_dispersion_pairpot.o /build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod qs_dispersion_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod particle_types.mod atprop_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod molecule_types.mod input_constants.mod mathconstants.mod cp_files.mod kinds.mod cp_output_handling.mod virial_methods.mod physcon.mod cp_parser_methods.mod message_passing.mod bibliography.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dispersion_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dispersion_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod input_section_types.mod qs_kind_types.mod qs_environment_types.mod qs_dispersion_types.mod input_constants.mod cp_log_handling.mod qs_dispersion_pairpot.mod base_hooks.mod cp_output_handling.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dispersion_utils.F qs_dispersion_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:05:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dispersion_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dispersion_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dispersion_utils.mod' due to: qs_dispersion_utils.o /build/reproducible-path/cp2k-8.1/src/qs_dispersion_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod input_section_types.mod qs_kind_types.mod qs_environment_types.mod qs_dispersion_types.mod input_constants.mod cp_log_handling.mod qs_dispersion_pairpot.mod base_hooks.mod cp_output_handling.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_parsing.mod' due to: input_parsing.o + 423 | Arhorhorho, beta, beta_1_1, beta_2_1, beta_3_1, beta_4_1, e_c_u_0, e_c_u_01rho, & + | ^ +note: 'beta' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_pbe.mod' due to: xc_pbe.o /build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod xc_input_constants.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_check.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_check.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod input_parsing.mod xc_input_constants.mod kinds.mod cp_units.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_check.F input_cp2k_check.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:05:32 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_check.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_check.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_check.mod' due to: input_cp2k_check.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_check.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod input_parsing.mod xc_input_constants.mod kinds.mod cp_units.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_functionals_utilities.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_functionals_utilities.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_functionals_utilities.F xc_functionals_utilities.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:18:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_functionals_utilities.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_functionals_utilities.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_functionals_utilities.F:68:31: + + 68 | SUBROUTINE setup_calculation(order, m, calc, tag) + | ^ +Warning: 'setup_calculation' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_functionals_utilities.mod' due to: xc_functionals_utilities.o /build/reproducible-path/cp2k-8.1/src/xc/xc_functionals_utilities.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod mathconstants.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dispersion_nonloc.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_types.mod pw_pool_types.mod virial_types.mod qs_dispersion_types.mod pw_grid_types.mod input_constants.mod pw_methods.mod base_hooks.mod mathconstants.mod message_passing.mod bibliography.mod cp_files.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F qs_dispersion_nonloc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:05:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dispersion_nonloc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dispersion_nonloc.F90 -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:598:61: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_perdew_wang.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.fypp xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod kinds.mod xc_functionals_utilities.mod xc_input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F xc_perdew_wang.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:18:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_perdew_wang.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_perdew_wang.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:632:65: - 598 | REAL(KIND=dp) :: g, g2, g2_last, g_multiplier, gm - | ^ -Warning: 'g' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:854:32: + 632 | + trz*r(1)*z(0, 2) + tzz*z(0, 2)*z(1, 0) + tz*z(1, 2) + | ^ +Warning: 'tzz' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:496:63: - 854 | IF (use_virial .AND. ABS(prefactor) > 0.0_dp) THEN - | ^ -Warning: 'prefactor' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:760:84: + 496 | tzz, tzzz + | ^ +note: 'tzz' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:603:56: - 760 | dq_6, e, f, P, prefactor, tmp_1_2, & - | ^ -note: 'prefactor' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:1051:105: + 603 | + tr*r(2) + tzz*z(1, 0)**2 + tz*z(2, 0) + | ^ +Warning: 'trz' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:89: - 1051 | dq0_dgradrho(i_grid) = total_rho(i_grid)*dq0_dq*2.0_dp*(-Z_ab)/(36.0_dp*kF*total_rho(i_grid)**2) - | ^ -Warning: 'z_ab' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:975:86: + 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +note: 'trz' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:603:56: - 975 | q_min, r_s, sqrt_r_s, Z_ab - | ^ -note: 'z_ab' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:1189:118: + 603 | + tr*r(2) + tzz*z(1, 0)**2 + tz*z(2, 0) + | ^ +Warning: 'trr' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:72: - 1189 | *(gradient_rho(i_grid, 1)**2 + gradient_rho(i_grid, 2)**2 + gradient_rho(i_grid, 3)**2) - | ^ -Warning: 'z_ab' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:1158:86: + 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +note: 'trr' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:99: - 1158 | q_min, r_s, sqrt_r_s, Z_ab - | ^ -note: 'z_ab' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dispersion_nonloc.mod' due to: qs_dispersion_nonloc.o /build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_types.mod pw_pool_types.mod virial_types.mod qs_dispersion_types.mod pw_grid_types.mod input_constants.mod pw_methods.mod base_hooks.mod mathconstants.mod message_passing.mod bibliography.mod cp_files.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ec_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/ec_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_dispersion_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod basis_set_container_types.mod ec_env_types.mod atomic_kind_types.mod input_section_types.mod qs_dispersion_utils.mod input_constants.mod string_utilities.mod input_cp2k_check.mod kinds.mod qs_interactions.mod qs_dispersion_pairpot.mod base_hooks.mod orbital_pointers.mod qs_dispersion_nonloc.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ec_environment.F ec_environment.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:05:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ec_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ec_environment.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ec_environment.mod' due to: ec_environment.o /build/reproducible-path/cp2k-8.1/src/ec_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_dispersion_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod basis_set_container_types.mod ec_env_types.mod atomic_kind_types.mod input_section_types.mod qs_dispersion_utils.mod input_constants.mod string_utilities.mod input_cp2k_check.mod kinds.mod qs_interactions.mod qs_dispersion_pairpot.mod base_hooks.mod orbital_pointers.mod qs_dispersion_nonloc.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_env_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_env_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod input_section_types.mod qs_environment_types.mod cp_control_types.mod input_constants.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/almo_scf_env_methods.F almo_scf_env_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:05:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_env_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_env_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_env_methods.mod' due to: almo_scf_env_methods.o /build/reproducible-path/cp2k-8.1/src/almo_scf_env_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod input_section_types.mod qs_environment_types.mod cp_control_types.mod input_constants.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xbecke_roussel.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F xc_xbecke_roussel.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:05:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbecke_roussel.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbecke_roussel.F90 -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2472:31: + 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +Warning: 'tz' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:597:37: - 2472 | t305 = t99*t271*R*t302 - | ^ -Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2304:36: + 597 | ed(m) = tr*r(1) + tz*z(1, 0) + | ^ +Warning: 'tr' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:67: - 2304 | t9, t91, t94, t97, t98, t99 - | ^ -note: 't99' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2578:28: + 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +note: 'tr' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:638:53: - 2578 | t614 = t43*t612*t98 - | ^ -Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2304:31: + 638 | + 3.0_dp*tzz*z(0, 1)*z(0, 2) + tz*z(0, 3) + | ^ +Warning: 'tzzz' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:496:69: - 2304 | t9, t91, t94, t97, t98, t99 - | ^ -note: 't98' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2572:34: + 496 | tzz, tzzz + | ^ +note: 'tzzz' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:624:65: - 2572 | + t36*t37/0.4e1_dp - | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2304:11: + 624 | + trz*r(1)*z(2, 0) + tzz*z(2, 0)*z(0, 1) + tz*z(2, 1) + | ^ +Warning: 'trzz' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:95: - 2304 | t9, t91, t94, t97, t98, t99 - | ^ -note: 't9' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2477:24: + 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +note: 'trzz' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:616:53: - 2477 | t318 = t123*t81 - | ^ -Warning: 't81' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:81: + 616 | + 3.0_dp*tzz*z(1, 0)*z(2, 0) + tz*z(3, 0) + | ^ +Warning: 'trrz' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:84: - 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & - | ^ -note: 't81' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2479:28: + 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +note: 'trrz' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:616:53: - 2479 | t330 = t179*t80*t98 - | ^ -Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:76: + 616 | + 3.0_dp*tzz*z(1, 0)*z(2, 0) + tz*z(3, 0) + | ^ +Warning: 'trrr' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:78: - 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & - | ^ -note: 't80' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2572:34: + 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +note: 'trrr' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_perdew_wang.mod' due to: xc_perdew_wang.o /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.fypp xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod kinds.mod xc_functionals_utilities.mod xc_input_constants.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xpbe_hole_t_c_lr.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathlib.mod mathconstants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F xc_xpbe_hole_t_c_lr.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:18:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xpbe_hole_t_c_lr.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xpbe_hole_t_c_lr.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2572 | + t36*t37/0.4e1_dp + 1058 | Clda)*sx | ^ -Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:71: +Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & - | ^ -note: 't8' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2435:25: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1070:24: - 2435 | t215 = t76*gamma - | ^ -Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:62: + 1070 | t586 = t86*t225 + | ^ +Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1020:32: - 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & - | ^ -note: 't76' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2542:24: + 1020 | t352 = 0.1e1_dp/t85/t33 + | ^ +Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2542 | t504 = t74*t227 - | ^ -Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:57: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & - | ^ -note: 't74' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2434:22: + 1058 | Clda)*sx + | ^ +Warning: 't81' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1031:23: - 2434 | t213 = t7*t54 - | ^ -Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:37: + 1031 | t415 = t79*t21 + | ^ +Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1066:38: - 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & - | ^ -note: 't7' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2430:25: + 1066 | t531 = F1*t235*t34 - t77*t529 + | ^ +Warning: 't77' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2430 | t205 = t66*gamma - | ^ -Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2302:58: + 1058 | Clda)*sx + | ^ +Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1034:23: - 2302 | t630, t64, t643, t645, t65, t650, t653, t656, t66, t662, t67, t678 - | ^ -note: 't66' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2440:32: + 1034 | t461 = t74*t21 + | ^ +Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2440 | t227 = 0.1e1_dp/t65/t29 - | ^ -Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2302:35: + 1058 | Clda)*sx + | ^ +Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2302 | t630, t64, t643, t645, t65, t650, t653, t656, t66, t662, t67, t678 - | ^ -note: 't65' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2540:23: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2540 | t500 = t64*t76 - | ^ + 1058 | Clda)*sx + | ^ Warning: 't64' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2302:18: - - 2302 | t630, t64, t643, t645, t65, t650, t653, t656, t66, t662, t67, t678 - | ^ -note: 't64' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2439:22: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't58' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1008:22: - 2439 | t224 = t6*t63 + 1008 | t305 = t56**2 | ^ -Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2301:96: +Warning: 't56' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2301 | t57, t574, t575, t578, t58, t597, t598, t6, t600, t61, t612, t614, t615, t62, t627, t63, & - | ^ -note: 't63' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2412:22: + 1058 | Clda)*sx + | ^ +Warning: 't52' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1007:28: - 2412 | t161 = t6*rho - | ^ -Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2301:51: + 1007 | t299 = 0.1e1_dp/t51 + | ^ +Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:978:47: - 2301 | t57, t574, t575, t578, t58, t597, t598, t6, t600, t61, t612, t614, t615, t62, t627, t63, & - | ^ -note: 't6' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2413:25: + 978 | t211 = 0.2e1_dp/0.3e1_dp*t50*t93*t7*t4 + | ^ +Warning: 't50' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2413 | t163 = t57*gamma - | ^ -Warning: 't57' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2301:12: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2301 | t57, t574, t575, t578, t58, t597, t598, t6, t600, t61, t612, t614, t615, t62, t627, t63, & - | ^ -note: 't57' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2538:23: + 1058 | Clda)*sx + | ^ +Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2538 | t496 = t55*t66 - | ^ -Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2300:81: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:996:27: - 2300 | t508, t510, t511, t52, t523, t526, t53, t539, t54, t541, t546, t549, t55, t552, t558, & - | ^ -note: 't55' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2437:26: + 996 | *t37*t248 + | ^ +Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2437 | t220 = t6*t54*t27 - | ^ -Warning: 't54' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2300:58: + 1058 | Clda)*sx + | ^ +Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2300 | t508, t510, t511, t52, t523, t526, t53, t539, t54, t541, t546, t549, t55, t552, t558, & - | ^ -note: 't54' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2425:22: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1002:45: - 2425 | t187 = t7*t45 - | ^ -Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2298:69: + 1002 | t280 = 0.1e1_dp/t21*t33*t276*t1*t278 + | ^ +Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:976:59: - 2298 | t413, t42, t426, t428, t43, t433, t436, t439, t44, t445, t45, t46, t461, t462, t465, & - | ^ -note: 't45' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2475:21: + 976 | t204 = 4*t193*t185 + 5*t196*t197 + 6*t200*t31*t174 + | ^ +Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:991:24: - 2475 | t310 = R*t43 - | ^ -Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2298:35: + 991 | t242 = t27*t225 + | ^ +Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1028:23: - 2298 | t413, t42, t426, t428, t43, t433, t436, t439, t44, t445, t45, t46, t461, t462, t465, & - | ^ -note: 't43' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2420:28: + 1028 | t406 = t25*t31 + | ^ +Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:985:54: - 2420 | t179 = 0.1e1_dp/t41 - | ^ -Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2297:87: + 985 | *t41 - 0.9e1_dp/0.4e1_dp*t22*t221*t204 + | ^ +Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1034:23: - 2297 | t365, t366, t368, t37, t371, t375, t379, t383, t387, t390, t392, t393, t4, t41, t410, & - | ^ -note: 't41' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2533:31: + 1034 | t461 = t74*t21 + | ^ +Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:988:24: - 2533 | - t36*t37*gamma - | ^ -Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2297:30: + 988 | t232 = t19*t225 + | ^ +Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1014:22: - 2297 | t365, t366, t368, t37, t371, t375, t379, t383, t387, t390, t392, t393, t4, t41, t410, & - | ^ -note: 't37' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2533:31: + 1014 | t330 = g4*t17 + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2533 | - t36*t37*gamma - | ^ -Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2296:97: + 1058 | Clda)*sx + | ^ +Warning: 't158' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2296 | REAL(KIND=dp) :: t318, t319, t330, t333, t336, t337, t340, t348, t35, t353, t356, t357, t36, & - | ^ -note: 't36' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2409:28: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2409 | t154 = 0.1e1_dp/t35 - | ^ -Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2296:74: + 1058 | Clda)*sx + | ^ +Warning: 't152' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1009:34: - 2296 | REAL(KIND=dp) :: t318, t319, t330, t333, t336, t337, t340, t348, t35, t353, t356, t357, t36, & - | ^ -note: 't35' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2427:25: + 1009 | t307 = 0.1e1_dp/t305*t150 + | ^ +Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2427 | t192 = t30*gamma - | ^ -Warning: 't30' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2295:39: + 1058 | Clda)*sx + | ^ +Warning: 't146' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't143' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2295 | t287, t29, t292, t294, t3, t30, t302, t305, t308, t31, t310, t315 - | ^ -note: 't30' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2440:32: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't142' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2440 | t227 = 0.1e1_dp/t65/t29 - | ^ -Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2295:18: + 1058 | Clda)*sx + | ^ +Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2295 | t287, t29, t292, t294, t3, t30, t302, t305, t308, t31, t310, t315 - | ^ -note: 't29' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2536:23: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2536 | t492 = t28*t57 - | ^ -Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2294:80: + 1058 | Clda)*sx + | ^ +Warning: 't138' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2294 | t237, t238, t24, t25, t26, t264, t267, t27, t270, t271, t274, t275, t28, t280, t285, & - | ^ -note: 't28' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2437:26: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't135' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2437 | t220 = t6*t54*t27 - | ^ -Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2294:51: + 1058 | Clda)*sx + | ^ +Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2294 | t237, t238, t24, t25, t26, t264, t267, t27, t270, t271, t274, t275, t28, t280, t285, & - | ^ -note: 't27' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2471:42: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:987:24: - 2471 | *t110*t275 - t109*t112/t26 - | ^ -Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2294:34: + 987 | t229 = t13*t225 + | ^ +Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2294 | t237, t238, t24, t25, t26, t264, t267, t27, t270, t271, t274, t275, t28, t280, t285, & + 1058 | Clda)*sx | ^ -note: 't26' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2419:49: +Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:999:28: - 2419 | *t4*t144*t19 - t175*t151/0.8e1_dp - | ^ -Warning: 't20' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2292:75: + 999 | t272 = t268/t12/t13 + | ^ +Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2292 | t179, t180, t182, t184, t185, t187, t19, t190, t192, t193, t2, t20, t201, t205, t206, & - | ^ -note: 't20' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2419:49: + 1058 | Clda)*sx + | ^ +Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2419 | *t4*t144*t19 - t175*t151/0.8e1_dp - | ^ -Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2292:48: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2292 | t179, t180, t182, t184, t185, t187, t19, t190, t192, t193, t2, t20, t201, t205, t206, & - | ^ -note: 't19' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2601:66: + 1058 | Clda)*sx + | ^ +Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2601 | *t271*t650/0.24e2_dp)*sx - | ^ -Warning: 't138' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:37: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:965:23: - 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & - | ^ -note: 't138' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2490:76: + 965 | t183 = t12*t11 + | ^ +Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: - 2490 | *t337*t138/0.8e1_dp - t348*t271*t302/0.24e2_dp)*sx - | ^ -Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:31: + 1058 | Clda)*sx + | ^ +Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: - 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & - | ^ -note: 't136' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2490:76: + 1090 | *t155)*Clda)*sx + | ^ +Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:653:49: - 2490 | *t337*t138/0.8e1_dp - t348*t271*t302/0.24e2_dp)*sx - | ^ -Warning: 't134' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:25: + 653 | - 0.9e1_dp/0.4e1_dp*t22*t265*t248 + | ^ +Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: - 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & - | ^ -note: 't134' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2490:76: + 779 | t409*(t281 - t235*t41*t292)) + | ^ +Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:696:42: - 2490 | *t337*t138/0.8e1_dp - t348*t271*t302/0.24e2_dp)*sx - | ^ -Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:19: + 696 | *(t262 - t235*t41*t248)) + | ^ +Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: - 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & - | ^ -note: 't133' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2599:36: + 779 | t409*(t281 - t235*t41*t292)) + | ^ +Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:709:29: - 2599 | - 0.4e1_dp*t679*t131 - | ^ -Warning: 't131' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:13: + 709 | t475 = t473*t87*t218 + | ^ +Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:701:23: - 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & - | ^ -note: 't131' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2471:42: + 701 | t429 = t86*t56 + | ^ +Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:696:42: - 2471 | *t110*t275 - t109*t112/t26 + 696 | *(t262 - t235*t41*t248)) | ^ -Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:89: +Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:696:42: Warning: 't77' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:722:23: - 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & - | ^ -note: 't13' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2487:36: + 722 | t541 = t73*t21 + | ^ +Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:772:38: - 2487 | - 0.4e1_dp*t337*t131 - | ^ -Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:84: + 772 | t677 = F1*t279*t34 - t71*t675 + | ^ +Warning: 't71' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & - | ^ -note: 't128' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2599:36: + 767 | Clda)*sx + | ^ +Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: - 2599 | - 0.4e1_dp*t679*t131 - | ^ -Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:78: + 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + | ^ +Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & - | ^ -note: 't126' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2467:25: + 767 | Clda)*sx + | ^ +Warning: 't64' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't58' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:701:23: - 2467 | t292 = t180*t125 - | ^ -Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:72: + 701 | t429 = t86*t56 + | ^ +Warning: 't56' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & - | ^ -note: 't125' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2487:36: + 767 | Clda)*sx + | ^ +Warning: 't52' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: - 2487 | - 0.4e1_dp*t337*t131 - | ^ -Warning: 't124' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:66: + 779 | t409*(t281 - t235*t41*t292)) + | ^ +Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:645:48: - 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & - | ^ -note: 't124' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2487:36: + 645 | t255 = 0.2e1_dp/0.3e1_dp*t50*t125*t7*t4 + | ^ +Warning: 't50' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: - 2487 | - 0.4e1_dp*t337*t131 - | ^ -Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:60: + 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + | ^ +Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & - | ^ -note: 't123' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2591:28: + 767 | Clda)*sx + | ^ +Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:628:24: - 2591 | *t653)*t121 - | ^ -Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:54: + 628 | t217 = t216*t40 + | ^ +Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:664:27: - 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & - | ^ -note: 't121' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2442:24: + 664 | *t37*t292 + | ^ +Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2442 | t229 = t228*t12 + 767 | Clda)*sx + | ^ +Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:658:24: + + 658 | t280 = t279*t34 | ^ -Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:48: +Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:705:33: - 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & - | ^ -note: 't12' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2450:25: + 705 | t445 = 0.1e1_dp/t117/t33 + | ^ +Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:720:25: - 2450 | t235 = t234*t118 + 720 | t533 = t25*t31*C | ^ -Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:37: - - 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & - | ^ -note: 't118' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2599:36: +Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:643:63: - 2599 | - 0.4e1_dp*t679*t131 - | ^ -Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:31: + 643 | t248 = 4*t237*t229 + 5*t240*t27*t218 + 6*t244*t31*t218 + | ^ +Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:720:25: - 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & - | ^ -note: 't117' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2487:36: + 720 | t533 = t25*t31*C + | ^ +Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:653:49: - 2487 | - 0.4e1_dp*t337*t131 - | ^ -Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:25: + 653 | - 0.9e1_dp/0.4e1_dp*t22*t265*t248 + | ^ +Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:715:24: - 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & - | ^ -note: 't116' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2460:34: + 715 | t504 = t429*t21 + | ^ +Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2460 | t270 = 0.1e1_dp/t115/t114 + 767 | Clda)*sx | ^ -Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:19: +Warning: 't202' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: - 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & - | ^ -note: 't115' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2460:34: + 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + | ^ +Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2460 | t270 = 0.1e1_dp/t115/t114 + 767 | Clda)*sx | ^ -Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:13: +Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:676:34: - 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & - | ^ -note: 't114' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2471:42: + 676 | t349 = 0.1e1_dp/t347*t194 + | ^ +Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2471 | *t110*t275 - t109*t112/t26 - | ^ -Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:97: + 767 | Clda)*sx + | ^ +Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:704:24: - 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't112' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2588:26: + 704 | t437 = t227*t19 + | ^ +Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: - 2588 | *t110*t275 - | ^ -Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:85: + 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + | ^ +Warning: 't187' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't110' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2588:26: + 767 | Clda)*sx + | ^ +Warning: 't183' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't181' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: - 2588 | *t110*t275 - | ^ -Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:79: + 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + | ^ +Warning: 't178' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't109' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2464:30: + 767 | Clda)*sx + | ^ +Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: - 2464 | t280 = t102*t103*t108 - | ^ -Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:73: + 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + | ^ +Warning: 't175' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't108' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2465:23: + 767 | Clda)*sx + | ^ +Warning: 't173' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: - 2465 | t285 = t106**2 - | ^ -Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:67: + 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + | ^ +Warning: 't170' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:641:22: - 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't106' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2466:25: + 641 | t240 = a4*t17 + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2466 | t287 = t105/t285 - | ^ -Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:61: + 767 | Clda)*sx + | ^ +Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't164' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't163' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't159' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: - 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't105' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2462:35: + 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + | ^ +Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2462 | t274 = t101*t104*t108*t110 - | ^ -Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:55: + 767 | Clda)*sx + | ^ +Warning: 't152' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: - 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't104' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2464:30: + 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + | ^ +Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: Warning: 't144' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:781:25: - 2464 | t280 = t102*t103*t108 - | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:49: + 781 | t720 = t143*t269 + | ^ +Warning: 't143' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't103' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2464:30: + 767 | Clda)*sx + | ^ +Warning: 't142' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: - 2464 | t280 = t102*t103*t108 - | ^ -Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:43: + 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + | ^ +Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't102' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2462:35: + 767 | Clda)*sx + | ^ +Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:655:24: - 2462 | t274 = t101*t104*t108*t110 - | ^ -Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:37: + 655 | t273 = t13*t269 + | ^ +Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't101' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2118:33: + 767 | Clda)*sx + | ^ +Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:644:34: - 2118 | t301 = t99*t299/0.3e1_dp - | ^ -Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:95: + 644 | t251 = t236*t125*t37*t248 + | ^ +Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 - | ^ -note: 't99' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2231:28: + 767 | Clda)*sx + | ^ +Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: - 2231 | t614 = t43*t612*t98 - | ^ -Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:90: + 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + | ^ +Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: - 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 - | ^ -note: 't98' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2225:34: + 779 | t409*(t281 - t235*t41*t292)) + | ^ +Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:788:25: - 2225 | + t36*t37/0.4e1_dp - | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:70: + 788 | t808 = t118*t269 + | ^ +Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:705:33: - 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 - | ^ -note: 't9' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2102:29: + 705 | t445 = 0.1e1_dp/t117/t33 + | ^ +Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:729:25: - 2102 | t259 = t81*t231*t257 - | ^ -Warning: 't81' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:51: + 729 | t612 = t429*t116 + | ^ +Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: - 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 - | ^ -note: 't81' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2124:24: + 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + | ^ +Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: - 2124 | t312 = t80*t231 - | ^ -Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:46: + 767 | Clda)*sx + | ^ +Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:681:23: - 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 - | ^ -note: 't80' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2225:34: + 681 | t373 = t73*t11 + | ^ +Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: - 2225 | + t36*t37/0.4e1_dp - | ^ -Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:41: + 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + | ^ +Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:710:30: - 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 - | ^ -note: 't8' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2080:25: + 710 | t479 = t108*t429*t331 + | ^ +Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:708:25: - 2080 | t211 = t76*gamma + 708 | t473 = t424*t107 | ^ -Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:32: +Warning: 't107' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:667:30: - 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 - | ^ -note: 't76' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2192:24: + 667 | t314 = t312*t106*t107 + | ^ +Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:726:25: - 2192 | t502 = t74*t223 - | ^ -Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:27: + 726 | t603 = t437*t105 + | ^ +Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:724:29: - 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 - | ^ -note: 't74' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2079:22: + 724 | t581 = t64*t118*t103 + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xpbe_hole_t_c_lr.mod' due to: xc_xpbe_hole_t_c_lr.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathlib.mod mathconstants.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xbeef.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod cp_array_utils.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F xc_xbeef.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:18:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbeef.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbeef.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F:489:109: - 2079 | t209 = t7*t54 - | ^ -Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1952:94: + 489 | e_rho_spin(ii) = e_rho_spin(ii) + (SUM(e_leg*a)*e_ueg_drho + SUM(de_leg*a)*dt*ds_rho*e_ueg)*sx + | ^ +Warning: 'dt' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F:489:109: Warning: 'ds_rho' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F:490:89: - 1952 | REAL(KIND=dp) :: t65, t651, t653, t655, t658, t66, t660, t662, t67, t674, t677, t690, t7, & - | ^ -note: 't7' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2075:25: + 490 | e_ndrho_spin(ii) = e_ndrho_spin(ii) + (SUM(de_leg*a)*dt*ds_ndrho*e_ueg)*sx + | ^ +Warning: 'ds_ndrho' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F:287:99: - 2075 | t201 = t66*gamma - | ^ -Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1952:55: + 287 | e_rho(ii) = e_rho(ii) + (SUM(e_leg*a)*e_ueg_drho + SUM(de_leg*a)*dt*ds_rho*e_ueg)*sx + | ^ +Warning: 'dt' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F:287:99: Warning: 'ds_rho' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F:288:79: - 1952 | REAL(KIND=dp) :: t65, t651, t653, t655, t658, t66, t660, t662, t67, t674, t677, t690, t7, & - | ^ -note: 't66' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2085:32: + 288 | e_ndrho(ii) = e_ndrho(ii) + (SUM(de_leg*a)*dt*ds_ndrho*e_ueg)*sx + | ^ +Warning: 'ds_ndrho' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xbeef.mod' due to: xc_xbeef.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod cp_array_utils.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xbecke88_long_range.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod cp_array_utils.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F xc_xbecke88_long_range.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:18:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbecke88_long_range.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbecke88_long_range.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: - 2085 | t223 = 0.1e1_dp/t65/t29 - | ^ -Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1952:26: + 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 + | ^ +Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:72: - 1952 | REAL(KIND=dp) :: t65, t651, t653, t655, t658, t66, t660, t662, t67, t674, t677, t690, t7, & - | ^ -note: 't65' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2190:23: + 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 + | ^ +note: 't98' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1261:104: - 2190 | t498 = t64*t76 - | ^ -Warning: 't64' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1951:70: + 1261 | *t68*t259 - 0.2222222224e0_dp*t24*t98*t358)*sx + | ^ +Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:61: - 1951 | t612, t614, t62, t625, t627, t629, t63, t630, t632, t633, t64, t649 - | ^ -note: 't64' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2084:22: + 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 + | ^ +note: 't95' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1313:70: - 2084 | t220 = t6*t63 - | ^ -Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1951:47: + 1313 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 + | ^ +Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:56: - 1951 | t612, t614, t62, t625, t627, t629, t63, t630, t632, t633, t64, t649 - | ^ -note: 't63' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2059:22: + 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 + | ^ +note: 't94' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1276:72: - 2059 | t162 = t6*rho - | ^ -Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1950:80: + 1276 | *t11*t91 + 0.40e1_dp*t382*t384 - 0.20e1_dp*t6*t401 + | ^ +Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:45: - 1950 | t547, t549, t55, t552, t554, t556, t568, t57, t571, t58, t584, t599, t6, t600, t601, t61, & - | ^ -note: 't6' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2060:25: + 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 + | ^ +note: 't91' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1202:30: - 2060 | t164 = t57*gamma - | ^ -Warning: 't57' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1950:53: + 1202 | t226 = t225*t90 + | ^ +Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:40: - 1950 | t547, t549, t55, t552, t554, t556, t568, t57, t571, t58, t584, t599, t6, t600, t601, t61, & - | ^ -note: 't57' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2188:23: + 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 + | ^ +note: 't90' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1273:55: - 2188 | t494 = t55*t66 - | ^ -Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1950:24: + 1273 | t87 + 0.8000000000e1_dp*t393*t397 + | ^ +Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:29: - 1950 | t547, t549, t55, t552, t554, t556, t568, t57, t571, t58, t584, t599, t6, t600, t601, t61, & - | ^ -note: 't55' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2082:26: + 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 + | ^ +note: 't87' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1328:66: - 2082 | t216 = t6*t54*t27 - | ^ -Warning: 't54' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1949:82: + 1328 | t525 = 0.120e2_dp*t508*t86 - 0.60e1_dp*t6*t521*t250 + | ^ +Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:12: - 1949 | t502, t503, t506, t508, t519, t52, t521, t523, t524, t526, t527, t53, t54, t543, t545, & - | ^ -note: 't54' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2070:22: + 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 + | ^ +note: 't86' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1375:39: - 2070 | t183 = t7*t45 - | ^ -Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1947:81: + 1375 | t669 = 0.1e1_dp/t85/t667 + | ^ +Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:89: - 1947 | t411, t412, t42, t428, t43, t430, t432, t434, t437, t439, t44, t441, t45, t453, t456, & - | ^ -note: 't45' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2094:28: + 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & + | ^ +note: 't85' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1374:28: - 2094 | t230 = t43*t228*t98 + 1374 | t667 = t84**2 | ^ -Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1947:35: +Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:72: - 1947 | t411, t412, t42, t428, t43, t430, t432, t434, t437, t439, t44, t441, t45, t453, t456, & - | ^ -note: 't43' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2067:28: + 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & + | ^ +note: 't84' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1159:28: - 2067 | t180 = 0.1e1_dp/t41 + 1159 | t140 = t8*rho | ^ -Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1946:93: +Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:61: - 1946 | t365, t367, t37, t371, t375, t379, t383, t386, t388, t4, t404, t406, t408, t409, t41, & - | ^ -note: 't41' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2183:31: + 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & + | ^ +note: 't8' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1393:67: - 2183 | - t36*t37*gamma - | ^ -Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1946:24: + 1393 | *t128*t43*t677 - 0.2666666667e1_dp*t42*pi*t79 + | ^ +Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:45: - 1946 | t365, t367, t37, t371, t375, t379, t383, t386, t388, t4, t404, t406, t408, t409, t41, & - | ^ -note: 't37' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2183:31: + 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & + | ^ +note: 't79' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1215:30: - 2183 | - t36*t37*gamma - | ^ -Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1945:85: + 1215 | t255 = t77*t254 + | ^ +Warning: 't77' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:40: - 1945 | REAL(KIND=dp) :: t313, t321, t326, t329, t339, t343, t35, t351, t354, t355, t36, t363, t364, & - | ^ -note: 't36' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2056:28: + 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & + | ^ +note: 't77' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - 2056 | t155 = 0.1e1_dp/t35 + 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:29: + + 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & + | ^ +note: 't76' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1370:28: + + 1370 | t639 = t75**2 | ^ -Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1945:62: +Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:24: - 1945 | REAL(KIND=dp) :: t313, t321, t326, t329, t339, t343, t35, t351, t354, t355, t36, t363, t364, & - | ^ -note: 't35' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2072:25: + 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & + | ^ +note: 't75' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1276:72: - 2072 | t188 = t30*gamma - | ^ -Warning: 't30' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1944:28: + 1276 | *t11*t91 + 0.40e1_dp*t382*t384 - 0.20e1_dp*t6*t401 + | ^ +Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:84: - 1944 | t297, t299, t3, t30, t301, t303, t306, t307, t308, t31, t310, t312 - | ^ -note: 't30' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2085:32: + 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & + | ^ +note: 't72' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - 2085 | t223 = 0.1e1_dp/t65/t29 - | ^ -Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1943:93: + 1442 | *t244*ndrho/t657/t7*t669) + | ^ +Warning: 't71' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:73: - 1943 | t26, t261, t262, t263, t265, t266, t269, t27, t272, t273, t278, t28, t283, t285, t29, & - | ^ -note: 't29' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2186:23: + 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & + | ^ +note: 't71' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1120:27: - 2186 | t490 = t28*t57 - | ^ -Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1943:76: + 1120 | t69 = t7*rho + | ^ +Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:68: - 1943 | t26, t261, t262, t263, t265, t266, t269, t27, t272, t273, t278, t28, t283, t285, t29, & - | ^ -note: 't28' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2082:26: + 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & + | ^ +note: 't7' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1382:63: - 2082 | t216 = t6*t54*t27 - | ^ -Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1943:53: + 1382 | /t69*t669) + | ^ +Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:64: - 1943 | t26, t261, t262, t263, t265, t266, t269, t27, t272, t273, t278, t28, t283, t285, t29, & + 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & + | ^ +note: 't69' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: + + 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:53: + + 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & | ^ -note: 't27' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2116:42: +note: 't68' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: - 2116 | *t110*t273 - t109*t112/t26 - | ^ -Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1943:12: + 1553 | t98*t1400 + | ^ +Warning: 't64' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:12: - 1943 | t26, t261, t262, t263, t265, t266, t269, t27, t272, t273, t278, t28, t283, t285, t29, & + 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & | ^ -note: 't26' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2066:49: +note: 't64' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1172:84: - 2066 | *t4*t145*t19 - t176*t152/0.8e1_dp - | ^ -Warning: 't20' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1941:57: + 1172 | 0.2222222224e0_dp*t24*t98*t155)*sx + | ^ +Warning: 't60' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:45: - 1941 | t182, t183, t186, t188, t189, t19, t197, t2, t20, t201, t202, t205, t206, t209, t211, & - | ^ -note: 't20' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2066:49: + 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & + | ^ +note: 't60' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - 2066 | *t4*t145*t19 - t176*t152/0.8e1_dp - | ^ -Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1941:42: + 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) + | ^ +Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:40: - 1941 | t182, t183, t186, t188, t189, t19, t197, t2, t20, t201, t202, t205, t206, t209, t211, & - | ^ -note: 't19' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2137:56: + 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & + | ^ +note: 't6' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1498:31: - 2137 | - t139*t269*t297/0.24e2_dp)*sx - | ^ -Warning: 't139' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1940:25: + 1498 | t1153 = t27*t590 + | ^ +Warning: 't590' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:36: - 1940 | t135, t138, t139, t145, t152, t155, t158, t159, t162, t164, t165, t176, t179, t180, t181, & + 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & + | ^ +note: 't590' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: + + 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:30: + + 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & + | ^ +note: 't59' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: + + 1544 | *t36*t38*t1396 + | ^ +Warning: 't586' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:25: + + 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & | ^ -note: 't139' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2137:56: +note: 't586' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - 2137 | - t139*t269*t297/0.24e2_dp)*sx - | ^ -Warning: 't138' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1940:19: + 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't580' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:19: - 1940 | t135, t138, t139, t145, t152, t155, t158, t159, t162, t164, t165, t176, t179, t180, t181, & + 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & | ^ -note: 't138' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2135:25: +note: 't580' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 2135 | /0.3e1_dp - | ^ -Warning: 't135' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1940:13: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't576' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:13: - 1940 | t135, t138, t139, t145, t152, t155, t158, t159, t162, t164, t165, t176, t179, t180, t181, & + 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & | ^ -note: 't135' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2135:25: +note: 't576' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - 2135 | /0.3e1_dp - | ^ -Warning: 't134' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:95: + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't575' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:96: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & - | ^ -note: 't134' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2249:70: + 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & + | ^ +note: 't575' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 2249 | t674 = (-t601 - t614 + t627 - t629 - t630 + t633 + t653)*t132 - | ^ -Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:89: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't574' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:90: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & - | ^ -note: 't132' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2116:42: + 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & + | ^ +note: 't574' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - 2116 | *t110*t273 - t109*t112/t26 - | ^ -Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:83: + 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't573' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:84: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & - | ^ -note: 't13' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2256:25: + 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & + | ^ +note: 't573' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - 2256 | /0.3e1_dp - | ^ -Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:78: + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't572' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:78: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ -note: 't129' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2135:25: +note: 't572' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - 2135 | /0.3e1_dp - | ^ -Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:72: + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't571' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:72: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ -note: 't125' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2069:25: +note: 't571' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - 2069 | t182 = t181*t124 - | ^ -Warning: 't124' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:66: + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't570' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:66: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ -note: 't124' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2135:25: +note: 't570' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 2135 | /0.3e1_dp - | ^ -Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:60: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't566' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:60: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ -note: 't123' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2245:69: +note: 't566' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 2245 | t655 = (t601 + t614 - t627 - t629 - t630 + t633 + t653)*t121 - | ^ -Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:54: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't562' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:54: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ -note: 't121' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2087:24: +note: 't562' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1169:26: - 2087 | t225 = t224*t12 - | ^ -Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:48: + 1169 | t151 + | ^ +Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:48: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ -note: 't12' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2104:25: +note: 't55' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - 2104 | t262 = t230*t118 - | ^ -Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:37: + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't539' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:43: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & + | ^ +note: 't539' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: + + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't537' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:37: + + 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ -note: 't118' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2106:27: +note: 't537' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - 2106 | t265 = t117*R*t257 - | ^ -Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:31: + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't536' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:31: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & | ^ -note: 't117' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2137:56: - - 2137 | - t139*t269*t297/0.24e2_dp)*sx - | ^ -Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:25: +note: 't536' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & - | ^ -note: 't116' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2108:45: + 1553 | t98*t1400 + | ^ +Warning: 't530' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:13: - 2108 | t269 = REAL(t100, KIND=dp)/t115/t114 - | ^ -Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:19: + 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & + | ^ +note: 't530' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1586:49: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & - | ^ -note: 't115' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2108:45: + 1586 | *sx + | ^ +Warning: 't529' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:93: - 2108 | t269 = REAL(t100, KIND=dp)/t115/t114 - | ^ -Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:13: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't529' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & - | ^ -note: 't114' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2116:42: + 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't526' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:87: - 2116 | *t110*t273 - t109*t112/t26 - | ^ -Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:97: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't526' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't112' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2242:26: + 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't525' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:81: - 2242 | *t110*t273 - | ^ -Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:85: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't525' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't110' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2242:26: + 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't521' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:75: - 2242 | *t110*t273 - | ^ -Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:79: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't521' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1184:59: - 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't109' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2111:30: + 1184 | *t52 - 0.5000000001e0_dp*t41*t172*t46 + | ^ +Warning: 't52' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:69: - 2111 | t278 = t102*t103*t108 - | ^ -Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:73: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't52' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1367:38: - 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't108' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2112:23: + 1367 | t624 = 0.1e1_dp/t8/t519 + | ^ +Warning: 't519' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:64: - 2112 | t283 = t106**2 - | ^ -Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:67: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't519' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't106' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2113:25: + 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't514' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:58: - 2113 | t285 = t105/t283 - | ^ -Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:61: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't514' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't105' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2109:35: + 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) + | ^ +Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:52: - 2109 | t272 = t101*t104*t108*t110 - | ^ -Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:55: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't513' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1244:33: - 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't104' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2111:30: + 1244 | t339 = t48*t10*t51 + | ^ +Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:46: - 2111 | t278 = t102*t103*t108 - | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:49: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't51' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't103' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2111:30: + 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't508' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:41: - 2111 | t278 = t102*t103*t108 - | ^ -Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:43: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't508' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: - 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't102' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2109:35: + 1553 | t98*t1400 + | ^ +Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:35: - 2109 | t272 = t101*t104*t108*t110 + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & | ^ -Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:37: - - 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & - | ^ -note: 't101' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1666:33: +note: 't505' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: - 1666 | t232 = 0.1e1_dp/t100/t99 - | ^ -Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1527:22: + 1553 | t98*t1400 + | ^ +Warning: 't502' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:29: - 1527 | t96, t97, t99 - | ^ -note: 't99' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1722:46: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't502' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1586:49: - 1722 | (-t385 - t341 + t387)*t95*t237 - | ^ -Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1527:17: + 1586 | *sx + | ^ +Warning: 't501' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:23: - 1527 | t96, t97, t99 - | ^ -note: 't97' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1802:88: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't501' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1382:63: - 1802 | - t580 + t618)*t95*t237 - | ^ -Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:95: + 1382 | /t69*t669) + | ^ +Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:17: - 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & - | ^ -note: 't95' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1802:88: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't5' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1431:30: - 1802 | - t580 + t618)*t95*t237 - | ^ -Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:90: + 1431 | t857 = t27*t496 + | ^ +Warning: 't496' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:13: - 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & - | ^ -note: 't94' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1722:46: + 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & + | ^ +note: 't496' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1485:76: - 1722 | (-t385 - t341 + t387)*t95*t237 - | ^ -Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:85: + 1485 | + t1136) + | ^ +Warning: 't492' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:96: - 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & - | ^ -note: 't93' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1672:22: + 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & + | ^ +note: 't492' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - 1672 | t247 = t91**2 - | ^ -Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:80: + 1456 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:90: - 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & - | ^ -note: 't91' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1673:24: + 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & + | ^ +note: 't49' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - 1673 | t249 = t90/t247 - | ^ -Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:75: + 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:85: - 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & - | ^ -note: 't90' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1623:23: + 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & + | ^ +note: 't489' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - 1623 | t134 = t133*t9 - | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:70: + 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't486' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:79: - 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & - | ^ -note: 't9' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1668:23: + 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & + | ^ +note: 't486' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - 1668 | t234 = t86*t89 - | ^ -Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:66: + 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't482' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:73: - 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & - | ^ -note: 't89' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1671:27: + 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & + | ^ +note: 't482' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - 1671 | t242 = t87*t88*t93 - | ^ -Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:61: + 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:62: - 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & - | ^ -note: 't88' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1671:27: + 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & + | ^ +note: 't479' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1470:68: - 1671 | t242 = t87*t88*t93 - | ^ -Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:56: + 1470 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 + | ^ +Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:56: - 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & + 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & | ^ -note: 't87' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1668:23: - - 1668 | t234 = t86*t89 - | ^ -Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:51: - - 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & - | ^ -note: 't86' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1679:31: +note: 't478' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - 1679 | t267 = t84*t233*R*t264 - | ^ -Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:41: + 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't473' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:50: - 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & - | ^ -note: 't84' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1789:28: + 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & + | ^ +note: 't473' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1470:68: - 1789 | t580 = t23*t578*t83 - | ^ -Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:36: + 1470 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 + | ^ +Warning: 't470' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:44: - 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & - | ^ -note: 't83' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1684:24: + 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & + | ^ +note: 't470' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1406:40: - 1684 | t280 = t108*t66 - | ^ -Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1525:53: + 1406 | REAL(t46, KIND=dp) + | ^ +Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:38: - 1525 | t629, t638, t65, t654, t655, t656, t659, t66, t67, t70, t73, t76 - | ^ -note: 't66' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1814:57: + 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & + | ^ +note: 't47' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - 1814 | + t581 - t596 - t655 - 0.4e1_dp*t656*t116 - | ^ -Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1525:24: + 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't467' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:33: - 1525 | t629, t638, t65, t654, t655, t656, t659, t66, t67, t70, t73, t76 - | ^ -note: 't65' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1641:25: + 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & + | ^ +note: 't467' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - 1641 | t177 = t61*gamma - | ^ -Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1524:50: + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't466' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:27: - 1524 | t58, t580, t581, t59, t593, t596, t6, t61, t612, t613, t614, t616, t618, t62, t623, t626, & - | ^ -note: 't61' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1795:21: + 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & + | ^ +note: 't466' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - 1795 | t612 = t3*t6 - | ^ -Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1524:45: + 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't465' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:71: - 1524 | t58, t580, t581, t59, t593, t596, t6, t61, t612, t613, t614, t616, t618, t62, t623, t626, & - | ^ -note: 't6' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1749:24: + 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 + | ^ +note: 't465' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - 1749 | t462 = t59*t189 - | ^ -Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1524:29: + 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't464' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:65: - 1524 | t58, t580, t581, t59, t593, t596, t6, t61, t612, t613, t614, t616, t618, t62, t623, t626, & - | ^ -note: 't59' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1636:25: + 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 + | ^ +note: 't464' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - 1636 | t167 = t51*gamma - | ^ -Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:90: + 1477 | t41*t328*t466 + | ^ +Warning: 't463' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:59: - 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & - | ^ -note: 't51' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1646:32: + 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 + | ^ +note: 't463' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - 1646 | t189 = 0.1e1_dp/t50/t32 - | ^ -Warning: 't50' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:67: + 1477 | t41*t328*t466 + | ^ +Warning: 't462' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:53: - 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & - | ^ -note: 't50' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1640:22: + 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 + | ^ +note: 't462' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - 1640 | t175 = t5*t39 - | ^ -Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:62: + 1456 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't460' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:47: - 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & - | ^ -note: 't5' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1747:23: + 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 + | ^ +note: 't460' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1184:59: - 1747 | t458 = t49*t61 - | ^ -Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:58: + 1184 | *t52 - 0.5000000001e0_dp*t41*t172*t46 + | ^ +Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:41: - 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & - | ^ -note: 't49' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1645:22: + 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 + | ^ +note: 't46' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - 1645 | t186 = t4*t48 - | ^ -Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:35: + 1456 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't457' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:36: - 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & - | ^ -note: 't48' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1633:25: + 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 + | ^ +note: 't457' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - 1633 | t159 = t42*gamma - | ^ -Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1520:74: + 1456 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't455' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:30: - 1520 | t385, t387, t39, t392, t395, t398, t4, t40, t402, t404, t409, t42, t420, t427, t428, & - | ^ -note: 't42' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1745:23: + 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 + | ^ +note: 't455' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1514:57: - 1745 | t454 = t40*t51 - | ^ -Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1520:51: + 1514 | + 0.5999999999e1_dp*t128*t132*t529 + | ^ +Warning: 't452' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:24: - 1520 | t385, t387, t39, t392, t395, t398, t4, t40, t402, t404, t409, t42, t420, t427, t428, & - | ^ -note: 't40' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1632:22: + 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 + | ^ +note: 't452' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - 1632 | t157 = t4*rho - | ^ -Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1520:46: + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't451' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:18: - 1520 | t385, t387, t39, t392, t395, t398, t4, t40, t402, t404, t409, t42, t420, t427, t428, & - | ^ -note: 't4' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1643:26: + 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 + | ^ +note: 't451' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1139:49: - 1643 | t182 = t4*t39*t30 - | ^ -Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1520:24: + 1139 | t103 = EXP(-0.9000000000e1_dp*t44) + | ^ +Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:12: - 1520 | t385, t387, t39, t392, t395, t398, t4, t40, t402, t404, t409, t42, t420, t427, t428, & - | ^ -note: 't39' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1622:25: + 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 + | ^ +note: 't44' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 1622 | t133 = t33*gamma - | ^ -Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1518:70: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't435' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:94: - 1518 | t302, t31, t310, t314, t315, t317, t318, t32, t324, t328, t33 - | ^ -note: 't33' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1646:32: + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & + | ^ +note: 't435' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1153:34: - 1646 | t189 = 0.1e1_dp/t50/t32 - | ^ -Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1518:53: + 1153 | t130 = t128*t43*t94 + | ^ +Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:88: - 1518 | t302, t31, t310, t314, t315, t317, t318, t32, t324, t328, t33 - | ^ -note: 't32' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1743:23: + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & + | ^ +note: 't43' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 1743 | t450 = t31*t42 - | ^ -Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1518:18: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:83: - 1518 | t302, t31, t310, t314, t315, t317, t318, t32, t324, t328, t33 - | ^ -note: 't31' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1664:25: + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & + | ^ +note: 't429' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - 1664 | t186*t191 - | ^ -Warning: 't30' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1517:97: + 1456 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:77: - 1517 | t264, t267, t27, t270, t272, t277, t28, t280, t281, t29, t292, t295, t298, t299, t3, t30, & - | ^ -note: 't30' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1630:22: + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & + | ^ +note: 't428' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1155:30: - 1630 | t153 = t4*t29 - | ^ -Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1517:64: + 1155 | t133 = t42*t132 + | ^ +Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:71: - 1517 | t264, t267, t27, t270, t272, t277, t28, t280, t281, t29, t292, t295, t298, t299, t3, t30, & - | ^ -note: 't29' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1682:21: + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & + | ^ +note: 't42' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 1682 | t272 = R*t23 - | ^ -Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1516:29: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't418' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:66: - 1516 | t22, t226, t229, t23, t232, t233, t234, t235, t237, t24, t242, t247, t249, t254, t256, & - | ^ -note: 't23' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1625:22: + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & + | ^ +note: 't418' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - 1625 | t138 = t21**2 - | ^ -Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1515:93: + 1456 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:60: - 1515 | t178, t18, t182, t183, t186, t189, t190, t191, t194, t196, t197, t199, t2, t200, t21, & - | ^ -note: 't21' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1620:22: + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & + | ^ +note: 't417' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 1620 | t128 = t5*t17 - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1514:71: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't413' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:54: - 1514 | t146, t153, t154, t157, t159, t16, t160, t163, t167, t168, t17, t171, t172, t175, t177, & - | ^ -note: 't17' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1816:66: + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & + | ^ +note: 't413' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1304:30: - 1816 | *t233*t623/0.24e2_dp)*sx - | ^ -Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:43: + 1304 | t489 = t41*t135 + | ^ +Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:42: - 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & - | ^ -note: 't123' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1697:76: + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & + | ^ +note: 't41' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: - 1697 | *t299*t123/0.8e1_dp - t310*t233*t264/0.24e2_dp)*sx + 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ -Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:37: +Warning: 't408' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:37: - 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ -note: 't121' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1697:76: +note: 't408' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: - 1697 | *t299*t123/0.8e1_dp - t310*t233*t264/0.24e2_dp)*sx + 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) | ^ -Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:31: +Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:31: - 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ -note: 't119' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1697:76: +note: 't405' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: - 1697 | *t299*t123/0.8e1_dp - t310*t233*t264/0.24e2_dp)*sx - | ^ -Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:25: + 1553 | t98*t1400 + | ^ +Warning: 't404' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:25: - 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ -note: 't118' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1814:57: +note: 't404' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - 1814 | + t581 - t596 - t655 - 0.4e1_dp*t656*t116 - | ^ -Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:19: + 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) + | ^ +Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:19: - 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & | ^ -note: 't116' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1694:36: +note: 't401' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - 1694 | - 0.4e1_dp*t299*t116 - | ^ -Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:96: + 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) + | ^ +Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:13: - 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & - | ^ -note: 't113' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1814:57: + 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & + | ^ +note: 't400' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1152:30: - 1814 | + t581 - t596 - t655 - 0.4e1_dp*t656*t116 - | ^ -Warning: 't111' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:90: - - 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & - | ^ -note: 't111' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1785:38: - - 1785 | t566 = t3*t443*t140*t110*t103 - | ^ -Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:84: - - 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & - | ^ -note: 't110' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1694:36: - - 1694 | - 0.4e1_dp*t299*t116 - | ^ -Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:78: - - 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & - | ^ -note: 't109' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1694:36: - - 1694 | - 0.4e1_dp*t299*t116 - | ^ -Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:72: - - 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & - | ^ -note: 't108' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1805:37: + 1152 | t128 = t40*t127 + | ^ +Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:92: - 1805 | /0.3e1_dp*t626)*t106 - | ^ -Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:66: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't40' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & - | ^ -note: 't106' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1785:38: + 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) + | ^ +Warning: 't397' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:87: - 1785 | t566 = t3*t443*t140*t110*t103 - | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:54: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't397' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & - | ^ -note: 't103' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1814:57: + 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't393' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:81: - 1814 | + t581 - t596 - t655 - 0.4e1_dp*t656*t116 - | ^ -Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:48: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't393' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1158:29: - 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & - | ^ -note: 't102' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1771:25: + 1158 | t137 = t39*t94 + | ^ +Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:75: - 1771 | t525 = t143*t101 - | ^ -Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:42: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't39' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & - | ^ -note: 't101' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1666:33: + 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) + | ^ +Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:70: - 1666 | t232 = 0.1e1_dp/t100/t99 - | ^ -Warning: 't100' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:36: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't384' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & - | ^ -note: 't100' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1678:86: + 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) + | ^ +Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:64: - 1678 | t256)*t95*t237 - t94*t97/t29 - | ^ -Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:30: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't383' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & - | ^ -note: 't10' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1328:43: + 1442 | *t244*ndrho/t657/t7*t669) + | ^ +Warning: 't382' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:58: - 1328 | t231 = REAL(t85, KIND=dp)/t100/t99 - | ^ -Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:51: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't382' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1257:68: - 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 - | ^ -note: 't99' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1384:50: + 1257 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 + | ^ +Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:52: - 1384 | t94*(-t317 - t340 + t358)*t95*t235 - | ^ -Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:46: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't38' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 - | ^ -note: 't97' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1466:88: + 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) + | ^ +Warning: 't377' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:47: - 1466 | - t587 + t600)*t95*t235 - | ^ -Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:36: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't377' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: - 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 - | ^ -note: 't95' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1466:88: + 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:41: - 1466 | - t587 + t600)*t95*t235 - | ^ -Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:31: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't372' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1286:30: - 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 - | ^ -note: 't94' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1384:50: + 1286 | t435 = t37*t196 + | ^ +Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:35: - 1384 | t94*(-t317 - t340 + t358)*t95*t235 - | ^ -Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:26: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't37' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: - 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 - | ^ -note: 't93' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1333:22: + 1553 | t98*t1400 + | ^ +Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:30: - 1333 | t245 = t91**2 - | ^ -Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:21: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't368' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: - 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 - | ^ -note: 't91' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1334:24: + 1553 | t98*t1400 + | ^ +Warning: 't365' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:24: - 1334 | t247 = t90/t245 + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & | ^ -Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:16: +note: 't365' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: - 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 - | ^ -note: 't90' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1283:23: + 1553 | t98*t1400 + | ^ +Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:18: - 1283 | t135 = t134*t9 - | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:11: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't36' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1363:30: - 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 - | ^ -note: 't9' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1329:23: + 1363 | t601 = t27*t358 + | ^ +Warning: 't358' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:13: - 1329 | t232 = t86*t89 - | ^ -Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:97: + 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & + | ^ +note: 't358' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: - 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & - | ^ -note: 't89' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1332:27: + 1421 | + 0.3333333334e0_dp*t36*t38*t838 + | ^ +Warning: 't354' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:96: - 1332 | t240 = t87*t88*t93 - | ^ -Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:92: + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & + | ^ +note: 't354' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & - | ^ -note: 't88' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1332:27: + 1477 | t41*t328*t466 + | ^ +Warning: 't351' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:90: - 1332 | t240 = t87*t88*t93 - | ^ -Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:87: + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & + | ^ +note: 't351' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & - | ^ -note: 't87' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1329:23: + 1477 | t41*t328*t466 + | ^ +Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:84: - 1329 | t232 = t86*t89 - | ^ -Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:82: + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & + | ^ +note: 't347' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1406:40: - 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & - | ^ -note: 't86' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1339:33: + 1406 | REAL(t46, KIND=dp) + | ^ +Warning: 't346' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:78: - 1339 | t263 = t84*t261/0.3e1_dp - | ^ -Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:72: + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & + | ^ +note: 't346' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & + 1477 | t41*t328*t466 + | ^ +Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:72: + + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & | ^ -note: 't84' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1455:28: +note: 't343' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - 1455 | t587 = t23*t585*t83 - | ^ -Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:67: + 1477 | t41*t328*t466 + | ^ +Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:61: - 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & - | ^ -note: 't83' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1322:29: + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & + | ^ +note: 't339' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1470:68: - 1322 | t221 = t66*t193*t219 - | ^ -Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:26: + 1470 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 + | ^ +Warning: 't335' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:55: - 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & - | ^ -note: 't66' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1394:35: + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & + | ^ +note: 't335' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1406:40: - 1394 | t414 = ndrho*t141*t65*t114 - | ^ -Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1187:70: + 1406 | REAL(t46, KIND=dp) + | ^ +Warning: 't330' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:49: - 1187 | t609, t61, t62, t628, t630, t632, t634, t639, t641, t645, t65, t655 - | ^ -note: 't65' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1300:25: + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & + | ^ +note: 't330' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - 1300 | t173 = t61*gamma - | ^ -Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1187:18: + 1477 | t41*t328*t466 + | ^ +Warning: 't328' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:43: - 1187 | t609, t61, t62, t628, t630, t632, t634, t639, t641, t645, t65, t655 - | ^ -note: 't61' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1451:35: + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & + | ^ +note: 't328' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - 1451 | t574 = t3*t6*t572/0.9e1_dp - | ^ -Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1186:73: + 1477 | t41*t328*t466 + | ^ +Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:37: - 1186 | t548, t56, t563, t57, t572, t574, t58, t585, t587, t59, t598, t6, t600, t605, t606, t608, & - | ^ -note: 't6' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1414:24: + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & + | ^ +note: 't326' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: - 1414 | t471 = t59*t185 - | ^ -Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1186:63: + 1421 | + 0.3333333334e0_dp*t36*t38*t838 + | ^ +Warning: 't325' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:31: - 1186 | t548, t56, t563, t57, t572, t574, t58, t585, t587, t59, t598, t6, t600, t605, t606, t608, & - | ^ -note: 't59' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1295:25: + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & + | ^ +note: 't325' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1463:38: - 1295 | t163 = t51*gamma - | ^ -Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1185:27: + 1463 | *t128*t323*t172 + | ^ +Warning: 't323' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:25: - 1185 | t499, t5, t50, t51, t516, t518, t52, t520, t522, t525, t526, t527, t530, t532, t545, & - | ^ -note: 't51' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1305:32: + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & + | ^ +note: 't323' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: - 1305 | t185 = 0.1e1_dp/t50/t32 - | ^ -Warning: 't50' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1185:22: + 1421 | + 0.3333333334e0_dp*t36*t38*t838 + | ^ +Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:19: - 1185 | t499, t5, t50, t51, t516, t518, t52, t520, t522, t525, t526, t527, t530, t532, t545, & - | ^ -note: 't50' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1359:22: + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & + | ^ +note: 't321' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: - 1359 | t312 = t5*t33 - | ^ -Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1185:17: + 1421 | + 0.3333333334e0_dp*t36*t38*t838 + | ^ +Warning: 't319' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:13: - 1185 | t499, t5, t50, t51, t516, t518, t52, t520, t522, t525, t526, t527, t530, t532, t545, & - | ^ -note: 't5' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1412:23: + 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & + | ^ +note: 't319' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: - 1412 | t467 = t49*t61 - | ^ -Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1184:64: + 1421 | + 0.3333333334e0_dp*t36*t38*t838 + | ^ +Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:97: - 1184 | t467, t468, t47, t471, t472, t475, t477, t48, t488, t49, t490, t493, t494, t496, t497, & - | ^ -note: 't49' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1304:22: + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & + | ^ +note: 't316' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 1304 | t182 = t4*t48 - | ^ -Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1184:53: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't313' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:91: - 1184 | t467, t468, t47, t471, t472, t475, t477, t48, t488, t49, t490, t493, t494, t496, t497, & - | ^ -note: 't48' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1292:25: + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & + | ^ +note: 't313' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - 1292 | t155 = t42*gamma - | ^ -Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1183:18: + 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't312' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:85: - 1183 | t414, t42, t423, t426, t43, t434, t443, t450, t455, t456, t459, t46, t460, t463, t464, & - | ^ -note: 't42' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1410:23: + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & + | ^ +note: 't312' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1226:31: - 1410 | t463 = t40*t51 - | ^ -Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1182:73: + 1226 | *t30*t281 + | ^ +Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:73: - 1182 | t367, t37, t38, t388, t39, t390, t392, t394, t397, t399, t4, t40, t403, t405, t409, t410, & + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ -note: 't40' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1291:22: +note: 't31' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1485:76: - 1291 | t153 = t4*rho - | ^ -Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1182:68: + 1485 | + t1136) + | ^ +Warning: 't304' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:68: - 1182 | t367, t37, t38, t388, t39, t390, t392, t394, t397, t399, t4, t40, t403, t405, t409, t410, & + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ -note: 't4' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1302:26: +note: 't304' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1144:26: - 1302 | t178 = t4*t39*t30 + 1144 | t109 | ^ -Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1182:34: +Warning: 't30' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:62: - 1182 | t367, t37, t38, t388, t39, t390, t392, t394, t397, t399, t4, t40, t403, t405, t409, t410, & - | ^ -note: 't39' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1282:25: + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & + | ^ +note: 't30' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1229:28: - 1282 | t134 = t33*gamma - | ^ -Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1180:70: + 1229 | t293 = t3*t55 + | ^ +Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:57: - 1180 | t305, t31, t312, t314, t315, t317, t319, t32, t323, t327, t33 - | ^ -note: 't33' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1305:32: + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & + | ^ +note: 't3' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 1305 | t185 = 0.1e1_dp/t50/t32 - | ^ -Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1180:53: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't297' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:53: - 1180 | t305, t31, t312, t314, t315, t317, t319, t32, t323, t327, t33 + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & | ^ -note: 't32' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1408:23: - - 1408 | t459 = t31*t42 - | ^ -Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1180:18: - - 1180 | t305, t31, t312, t314, t315, t317, t319, t32, t323, t327, t33 - | ^ -note: 't31' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1321:25: +note: 't297' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 1321 | t182*t187 - | ^ -Warning: 't30' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1179:91: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:47: - 1179 | t265, t268, t269, t27, t270, t272, t274, t275, t28, t283, t288, t29, t291, t3, t30, t301, & - | ^ -note: 't30' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1289:22: + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & + | ^ +note: 't293' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1194:35: - 1289 | t149 = t4*t29 - | ^ + 1194 | t211 = rho*t29*omega + | ^ Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1179:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:41: - 1179 | t265, t268, t269, t27, t270, t272, t274, t275, t28, t283, t288, t29, t291, t3, t30, t301, & - | ^ + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & + | ^ note: 't29' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1314:28: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 1314 | t192 = t23*t190*t83 - | ^ -Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1178:30: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't289' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:36: - 1178 | t225, t227, t228, t23, t231, t232, t233, t235, t24, t240, t245, t247, t259, t261, t263, & - | ^ -note: 't23' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1285:22: + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & + | ^ +note: 't289' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - 1285 | t139 = t21**2 - | ^ -Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1177:63: + 1456 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't285' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:30: - 1177 | t18, t182, t185, t186, t187, t190, t192, t193, t2, t21, t219, t22, t221, t223, t224, & - | ^ -note: 't21' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1280:22: + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & + | ^ +note: 't285' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: - 1280 | t129 = t5*t17 - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1176:65: + 1421 | + 0.3333333334e0_dp*t36*t38*t838 + | ^ +Warning: 't284' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:24: - 1176 | t153, t155, t156, t159, t16, t163, t164, t167, t168, t17, t171, t173, t174, t178, t179, & - | ^ -note: 't17' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1358:56: + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & + | ^ +note: 't284' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - 1358 | - t124*t231*t259/0.24e2_dp)*sx - | ^ -Warning: 't124' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1175:31: + 1456 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't281' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:18: - 1175 | t119, t120, t123, t124, t129, t132, t134, t135, t138, t139, t141, t142, t143, t149, t150, & - | ^ -note: 't124' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1358:56: + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & + | ^ +note: 't281' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1141:30: - 1358 | - t124*t231*t259/0.24e2_dp)*sx - | ^ -Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1175:25: + 1141 | t105 = t28*t104 + | ^ +Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:12: - 1175 | t119, t120, t123, t124, t129, t132, t134, t135, t138, t139, t141, t142, t143, t149, t150, & - | ^ -note: 't123' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1356:25: + 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & + | ^ +note: 't28' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 1356 | /0.3e1_dp - | ^ -Warning: 't120' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1175:19: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't271' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:95: - 1175 | t119, t120, t123, t124, t129, t132, t134, t135, t138, t139, t141, t142, t143, t149, t150, & - | ^ -note: 't120' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1356:25: + 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + | ^ +note: 't271' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - 1356 | /0.3e1_dp - | ^ -Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1175:13: + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't270' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:89: - 1175 | t119, t120, t123, t124, t129, t132, t134, t135, t138, t139, t141, t142, t143, t149, t150, & - | ^ -note: 't119' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1473:70: + 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + | ^ +note: 't270' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - 1473 | t655 = (-t574 - t587 + t600 - t605 - t606 + t609 + t632)*t117 - | ^ -Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:96: + 1456 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't265' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:78: - 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & - | ^ -note: 't117' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1479:54: + 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + | ^ +note: 't265' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - 1479 | *t114 - t301*t608 - t120*t630/0.3e1_dp - | ^ -Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:90: + 1456 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't264' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:72: - 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & - | ^ -note: 't114' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1356:25: + 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + | ^ +note: 't264' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: - 1356 | /0.3e1_dp - | ^ -Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:84: + 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 + | ^ +Warning: 't259' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:61: - 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & - | ^ -note: 't110' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1460:47: + 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + | ^ +note: 't259' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: - 1460 | t605 = t3*t450*t141*t109*t103/0.9e1_dp - | ^ -Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:78: + 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:55: - 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & - | ^ -note: 't109' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1356:25: + 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + | ^ +note: 't258' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - 1356 | /0.3e1_dp - | ^ -Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:72: + 1442 | *t244*ndrho/t657/t7*t669) + | ^ +Warning: 't255' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:49: - 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & - | ^ -note: 't108' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1469:69: + 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + | ^ +note: 't255' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - 1469 | t634 = (t574 + t587 - t600 - t605 - t606 + t609 + t632)*t106 - | ^ -Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:66: + 1442 | *t244*ndrho/t657/t7*t669) + | ^ +Warning: 't254' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:43: - 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & - | ^ -note: 't106' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1460:47: + 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + | ^ +note: 't254' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - 1460 | t605 = t3*t450*t141*t109*t103/0.9e1_dp - | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:54: + 1442 | *t244*ndrho/t657/t7*t669) + | ^ +Warning: 't251' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:37: - 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & - | ^ -note: 't103' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1326:27: + 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + | ^ +note: 't251' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - 1326 | t227 = t102*R*t219 - | ^ -Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:48: + 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:31: - 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & - | ^ -note: 't102' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1358:56: + 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + | ^ +note: 't250' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - 1358 | - t124*t231*t259/0.24e2_dp)*sx - | ^ -Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:42: + 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) + | ^ +Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:25: - 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & - | ^ -note: 't101' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1328:43: + 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + | ^ +note: 't245' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - 1328 | t231 = REAL(t85, KIND=dp)/t100/t99 - | ^ -Warning: 't100' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:36: + 1442 | *t244*ndrho/t657/t7*t669) + | ^ +Warning: 't244' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:19: - 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & - | ^ -note: 't100' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1337:86: + 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + | ^ +note: 't244' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - 1337 | t221)*t95*t235 - t94*t97/t29 - | ^ -Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:30: + 1442 | *t244*ndrho/t657/t7*t669) + | ^ +Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:13: - 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & - | ^ -note: 't10' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:959:23: + 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + | ^ +note: 't241' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: - 959 | t204 = t203*t9 - | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: + 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 + | ^ +Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:96: - 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx - | ^ -Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:941:24: + 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & + | ^ +note: 't24' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - 941 | t160 = t85*t103 - | ^ -Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:952:25: + 1442 | *t244*ndrho/t657/t7*t669) + | ^ +Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:91: - 952 | t190 = t81*gamma - | ^ -Warning: 't81' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1026:24: + 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & + | ^ +note: 't237' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - 1026 | t399 = t79*t202 - | ^ -Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:947:25: + 1442 | *t244*ndrho/t657/t7*t669) + | ^ +Warning: 't233' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:85: - 947 | t180 = t71*gamma - | ^ -Warning: 't71' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:957:32: + 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & + | ^ +note: 't233' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - 957 | t202 = 0.1e1_dp/t70/t35 - | ^ -Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1024:23: + 1442 | *t244*ndrho/t657/t7*t669) + | ^ +Warning: 't232' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:79: - 1024 | t395 = t69*t81 - | ^ -Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:956:22: + 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & + | ^ +note: 't232' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - 956 | t199 = t3*t68 - | ^ -Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:932:25: + 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't230' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:67: - 932 | t142 = t62*gamma - | ^ -Warning: 't62' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1022:23: + 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & + | ^ +note: 't230' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1140:34: - 1022 | t391 = t60*t71 - | ^ -Warning: 't60' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1043:32: + 1140 | t104 = 0.1e1_dp/t23 + | ^ +Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:61: - 1043 | t42*t43/0.4e1_dp - | ^ -Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1007:58: + 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & + | ^ +note: 't23' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - 1007 | *t313 - 0.80e2_dp/0.729e3_dp*t99*t195*t317 - | ^ -Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1015:22: + 1442 | *t244*ndrho/t657/t7*t669) + | ^ +Warning: 't226' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:56: - 1015 | t376 = t5*t36 - | ^ -Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:976:22: + 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & + | ^ +note: 't226' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - 976 | t245 = t49**2 - | ^ -Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:939:28: + 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) + | ^ +Warning: 't225' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:50: - 939 | t158 = 0.1e1_dp/t47 - | ^ -Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1018:31: + 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & + | ^ +note: 't225' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - 1018 | - t42*t43*gamma - | ^ -Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:934:23: + 1442 | *t244*ndrho/t657/t7*t669) + | ^ +Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:44: - 934 | t154 = t42*t23 - | ^ -Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:929:28: + 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & + | ^ +note: 't222' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1368:30: - 929 | t134 = 0.1e1_dp/t41 - | ^ -Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:994:51: + 1368 | t628 = t221*t76 + | ^ +Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:38: - 994 | ndrho/0.9e1_dp + t154*t285/0.4e1_dp - | ^ -Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:944:25: + 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & + | ^ +note: 't221' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1119:34: - 944 | t167 = t36*gamma - | ^ -Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:957:32: + 1119 | t68 = rho*t22*omega + | ^ +Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:32: - 957 | t202 = 0.1e1_dp/t70/t35 + 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & | ^ -Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1020:23: +note: 't22' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1382:63: - 1020 | t387 = t34*t62 - | ^ -Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:928:40: + 1382 | /t69*t669) + | ^ +Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:27: - 928 | t131 = 0.1e1_dp/t4/t33*gamma*t9 - | ^ -Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:930:22: + 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & + | ^ +note: 't219' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: - 930 | t137 = t3*t32 - | ^ -Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: + 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 + | ^ +Warning: 't216' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:70: - 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx - | ^ -Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:938:53: + 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 + | ^ +note: 't216' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: - 938 | t42*t23*t124*t16 - t154*t131/0.8e1_dp - | ^ -Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1043:32: + 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 + | ^ +Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:64: - 1043 | t42*t43/0.4e1_dp - | ^ -Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:977:29: + 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 + | ^ +note: 't213' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: - 977 | t248 = t21*t106/t245 - | ^ -Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:974:21: + 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:58: - 974 | *t204 - | ^ -Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:942:22: + 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 + | ^ +note: 't212' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: - 942 | t162 = t4*t17 - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:938:53: + 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't211' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:52: - 938 | t42*t23*t124*t16 - t154*t131/0.8e1_dp - | ^ -Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: + 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 + | ^ +note: 't211' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1232:30: - 1058 | /0.2e1_dp))*sx - | ^ -Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: Warning: 't111' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: + 1232 | t311 = t126*t21 + | ^ +Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:46: - 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx - | ^ -Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:978:25: + 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 + | ^ +note: 't21' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: - 978 | t249 = t109*t102 - | ^ -Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:979:29: + 1553 | t98*t1400 + | ^ +Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:41: - 979 | t255 = t21*t106*t108 + 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 + | ^ +note: 't207' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1263:30: + + 1263 | t365 = t27*t200 + | ^ +Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:35: + + 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 + | ^ +note: 't200' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1346:29: + + 1346 | t576 = t2*t501 | ^ -Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: +Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:29: - 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx - | ^ -Warning: 't107' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: + 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 + | ^ +note: 't2' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1313:70: - 1058 | /0.2e1_dp))*sx - | ^ -Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1052:53: + 1313 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 + | ^ +Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:25: - 1052 | t487 = t459*t160 + t472*t103 - t86*t211*t484 - | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: + 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 + | ^ +note: 't196' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx - | ^ -Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: + 1477 | t41*t328*t466 + | ^ +Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:19: - 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx - | ^ -Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: Warning: 't96' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: + 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 + | ^ +note: 't190' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - 729 | *t199/0.2e1_dp - t71*t88*t227*t96/0.2e1_dp))*sx + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ -Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: - - 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx - | ^ -Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:719:27: +Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:13: - 719 | t217 = t21*t91*t93 - | ^ -Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: + 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 + | ^ +note: 't186' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - 729 | *t199/0.2e1_dp - t71*t88*t227*t96/0.2e1_dp))*sx + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ -Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: +Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:96: - 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx - | ^ -Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:699:23: + 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & + | ^ +note: 't185' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1176:59: - 699 | t166 = t165*t9 - | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:792:24: + 1176 | t172 = 0.40e1_dp*t11*t18 - 0.20e1_dp*t6*t169 + | ^ +Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:90: - 792 | t436 = t435*t88 - | ^ -Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: + 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & + | ^ +note: 't18' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - 729 | *t199/0.2e1_dp - t71*t88*t227*t96/0.2e1_dp))*sx + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) | ^ -Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: Warning: 't71' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:731:24: +Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:85: - 731 | t249 = t120*t70 - | ^ -Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:692:25: + 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & + | ^ +note: 't177' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1318:79: - 692 | t152 = t66*gamma - | ^ -Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:768:24: + 1318 | *t24*t98*t496)*sx + | ^ +Warning: 't173' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:73: - 768 | t361 = t64*t164 - | ^ -Warning: 't64' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:687:25: + 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & + | ^ +note: 't173' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1355:35: - 687 | t142 = t56*gamma - | ^ -Warning: 't56' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:697:32: + 1355 | *t36*t38*t586 + | ^ +Warning: 't172' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:67: - 697 | t164 = 0.1e1_dp/t55/t37 - | ^ -Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:766:23: + 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & + | ^ +note: 't172' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1122:28: - 766 | t357 = t54*t66 - | ^ -Warning: 't54' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:696:22: + 1122 | t72 = t71*t17 + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:61: - 696 | t161 = t3*t53 - | ^ -Warning: 't53' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:757:22: + 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & + | ^ +note: 't17' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1331:41: - 757 | t340 = t5*t38 - | ^ -Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:684:25: + 1331 | - 0.20e1_dp*t6*t526 + | ^ +Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:56: - 684 | t134 = t47*gamma - | ^ -Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:764:23: + 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & + | ^ +note: 't169' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1266:31: - 764 | t353 = t45*t56 - | ^ -Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:745:58: + 1266 | t377 = t225*t168 + | ^ +Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:50: - 745 | *t267 - 0.80e2_dp/0.729e3_dp*t84*t157*t271 - | ^ -Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:730:22: + 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & + | ^ +note: 't168' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1203:38: - 730 | t246 = t4*t38 - | ^ -Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: + 1203 | t230 = 0.1e1_dp/t75/t16 + | ^ +Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:44: - 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx - | ^ -Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:697:32: + 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & + | ^ +note: 't16' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1193:30: - 697 | t164 = 0.1e1_dp/t55/t37 + 1193 | t207 = t27*t155 + | ^ +Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:32: + + 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ -Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:762:23: +note: 't155' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1257:68: - 762 | t349 = t36*t47 - | ^ -Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:694:26: + 1257 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 + | ^ +Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:26: - 694 | t157 = t3*t44*t35 + 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & | ^ -Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:756:46: - - 756 | /0.2e1_dp))*sx - | ^ -Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: - - 729 | *t199/0.2e1_dp - t71*t88*t227*t96/0.2e1_dp))*sx - | ^ -Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:716:22: +note: 't151' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1308:82: - 716 | t207 = t28**2 - | ^ -Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:678:22: + 1308 | - 0.5555555558e-1_dp*t146*t486 - 0.5000000001e0_dp*t489*t466 + | ^ +Warning: 't148' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:20: - 678 | t118 = t26**2 - | ^ -Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: + 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & + | ^ +note: 't148' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx - | ^ -Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:714:21: + 1477 | t41*t328*t466 + | ^ +Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:93: - 714 | *t166 - | ^ -Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:673:22: + 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & + | ^ +note: 't147' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - 673 | t108 = t4*t17 - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: + 1477 | t41*t328*t466 + | ^ +Warning: 't146' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:80: - 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx - | ^ -Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: Warning: 't100' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xbecke_roussel.mod' due to: xc_xbecke_roussel.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xbecke88.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod cp_array_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88.F xc_xbecke88.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:05:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbecke88.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbecke88.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xbecke88.mod' due to: xc_xbecke88.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod cp_array_utils.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_b97.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_b97.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod xc_input_constants.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_b97.F xc_b97.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:06:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_b97.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_b97.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_b97.mod' due to: xc_b97.o /build/reproducible-path/cp2k-8.1/src/xc/xc_b97.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod xc_input_constants.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_functionals_utilities.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_functionals_utilities.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_functionals_utilities.F xc_functionals_utilities.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:06:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_functionals_utilities.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_functionals_utilities.F90 -/build/reproducible-path/cp2k-8.1/src/xc/xc_functionals_utilities.F:68:31: + 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & + | ^ +note: 't146' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1308:82: - 68 | SUBROUTINE setup_calculation(order, m, calc, tag) - | ^ -Warning: 'setup_calculation' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_functionals_utilities.mod' due to: xc_functionals_utilities.o /build/reproducible-path/cp2k-8.1/src/xc/xc_functionals_utilities.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_vwn.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod xc_input_constants.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F xc_vwn.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:06:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_vwn.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_vwn.F90 -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1476:30: + 1308 | - 0.5555555558e-1_dp*t146*t486 - 0.5000000001e0_dp*t489*t466 + | ^ +Warning: 't143' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:60: - 1476 | t288 = t287*t97 - | ^ -Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1272:35: + 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & + | ^ +note: 't143' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1245:35: - 1272 | t945, t948, t957, t96, t97, t972, t979, t982, t984, t986, t993, t996, x0p + 1245 | t343 = t141*t135*t46 | ^ -note: 't97' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1484:72: +Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:47: - 1484 | t109*(t295*t96 + 0.3177280975e0_dp*t298*t284)*t122 - | ^ -Warning: 't96' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1272:30: + 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & + | ^ +note: 't141' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - 1272 | t945, t948, t957, t96, t97, t972, t979, t982, t984, t986, t993, t996, x0p - | ^ -note: 't96' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1508:56: + 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:20: - 1508 | t55 + t93 + t127)*sc - | ^ -Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1271:85: + 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & + | ^ +note: 't140' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1406:40: - 1271 | t890, t891, t893, t896, t9, t90, t901, t903, t905, t906, t91, t914, t92, t93, t937, t942, & - | ^ -note: 't93' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1424:30: + 1406 | REAL(t46, KIND=dp) + | ^ +Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:89: - 1424 | t206 = t144*t92 - | ^ -Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1271:80: + 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & + | ^ +note: 't137' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1470:68: - 1271 | t890, t891, t893, t896, t9, t90, t901, t903, t905, t906, t91, t914, t92, t93, t937, t942, & - | ^ -note: 't92' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1765:30: + 1470 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 + | ^ +Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:83: - 1765 | t752 = t90*t751 + 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & + | ^ +note: 't136' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1304:30: + + 1304 | t489 = t41*t135 | ^ -Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1271:40: +Warning: 't135' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:77: - 1271 | t890, t891, t893, t896, t9, t90, t901, t903, t905, t906, t91, t914, t92, t93, t937, t942, & - | ^ -note: 't90' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1769:29: + 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & + | ^ +note: 't135' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1219:69: - 1769 | t757 = t89*t91 - | ^ -Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1270:92: + 1219 | t264 = 0.9000000000e1_dp*t130 - 0.6000000000e1_dp*t133 + | ^ +Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:50: - 1270 | REAL(KIND=dp) :: t865, t866, t869, t870, t873, t874, t875, t878, t881, t884, t887, t89, & - | ^ -note: 't89' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1666:64: + 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & + | ^ +note: 't133' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1514:57: - 1666 | *t583*t548)*t86)*t91 - | ^ -Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1269:59: + 1514 | + 0.5999999999e1_dp*t128*t132*t529 + | ^ +Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:44: - 1269 | t833, t834, t835, t84, t842, t851, t857, t859, t86, t862, t864 - | ^ -note: 't86' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2165:60: + 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & + | ^ +note: 't132' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1219:69: - 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 - | ^ -Warning: 't834' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1269:19: + 1219 | t264 = 0.9000000000e1_dp*t130 - 0.6000000000e1_dp*t133 + | ^ +Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:38: - 1269 | t833, t834, t835, t84, t842, t851, t857, t859, t86, t862, t864 - | ^ -note: 't834' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & + | ^ +note: 't130' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1237:35: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't833' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1269:13: + 1237 | t321 = t128*t43*t258 + | ^ +Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:25: - 1269 | t833, t834, t835, t84, t842, t851, t857, t859, t86, t862, t864 - | ^ -note: 't833' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2243:80: + 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & + | ^ +note: 't128' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1299:30: - 2243 | 0.3e1_dp*t1765 + 0.120e2_dp*t1858*t327 - 0.120e2_dp*t1776 - | ^ -Warning: 't832' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:97: + 1299 | t473 = t94*t127 + | ^ +Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:19: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & - | ^ -note: 't832' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: + 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & + | ^ +note: 't127' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1232:30: - 2099 | + t842 - t1609 - | ^ -Warning: 't831' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:91: + 1232 | t311 = t126*t21 + | ^ +Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:13: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & - | ^ -note: 't831' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2165:60: + 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & + | ^ +note: 't126' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1313:70: - 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 - | ^ -Warning: 't830' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:85: + 1313 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 + | ^ +Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:85: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & | ^ -note: 't830' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: +note: 't122' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1174:67: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't829' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:79: + 1174 | t168 = 0.60e1_dp*beta*t3*t12 + 0.60e1_dp*t11*t10*t86 + | ^ +Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:79: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & | ^ -note: 't829' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2243:80: +note: 't12' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1257:68: - 2243 | 0.3e1_dp*t1765 + 0.120e2_dp*t1858*t327 - 0.120e2_dp*t1776 - | ^ -Warning: 't828' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:73: + 1257 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 + | ^ +Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:74: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & - | ^ -note: 't828' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: + 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & + | ^ +note: 't118' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 2099 | + t842 - t1609 + 1544 | *t36*t38*t1396 | ^ -Warning: 't827' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:67: +Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:61: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & - | ^ -note: 't827' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2165:60: + 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & + | ^ +note: 't117' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: - 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 - | ^ -Warning: 't826' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:61: + 1553 | t98*t1400 + | ^ +Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:41: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & - | ^ -note: 't826' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & + | ^ +note: 't116' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't825' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:55: + 1544 | *t36*t38*t1396 + | ^ +Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:89: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & - | ^ -note: 't825' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & + | ^ +note: 't113' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't824' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:49: + 1456 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:83: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & - | ^ -note: 't824' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: + 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & + | ^ +note: 't112' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - 2099 | + t842 - t1609 - | ^ -Warning: 't823' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:43: + 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:70: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & - | ^ -note: 't823' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2215:50: + 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & + | ^ +note: 't11' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1284:66: - 2215 | - t820 + t486 + t603 - t822 - | ^ -Warning: 't822' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:37: + 1284 | *t31*t404 - 0.5000000000e0_dp*t105*t109*t172 + | ^ +Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:58: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & - | ^ -note: 't822' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & + | ^ +note: 't109' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1355:35: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't821' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:31: + 1355 | *t36*t38*t586 + | ^ +Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:45: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & - | ^ -note: 't821' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2215:50: + 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & + | ^ +note: 't105' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1364:36: - 2215 | - t820 + t486 + t603 - t822 - | ^ -Warning: 't820' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:25: + 1364 | t605 = rho*t104*omega + | ^ +Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:32: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & - | ^ -note: 't820' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & + | ^ +note: 't104' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1355:35: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't819' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:19: + 1355 | *t36*t38*t586 + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:26: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & - | ^ -note: 't819' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: + 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & + | ^ +note: 't103' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1174:67: - 2099 | + t842 - t1609 - | ^ -Warning: 't818' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:13: + 1174 | t168 = 0.60e1_dp*beta*t3*t12 + 0.60e1_dp*t11*t10*t86 + | ^ +Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1037:77: - 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & - | ^ -note: 't818' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2215:50: + 1037 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, ndrho, rho, t1, t10, t100, t1002, t1009, & + | ^ +note: 't10' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1186:69: - 2215 | - t820 + t486 + t603 - t822 - | ^ -Warning: 't817' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:94: + 1186 | t117*t118*t172 + 0.3333333334e0_dp*t36*t38*t196 + | ^ +Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1037:72: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't817' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + 1037 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, ndrho, rho, t1, t10, t100, t1002, t1009, & + | ^ +note: 't1' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't816' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:88: + 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 + | ^ +Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:287:26: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't816' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + 287 | REAL(kind=dp) :: t98, t99, xx + | ^ +note: 't98' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:492:94: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't815' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:82: + 492 | *t68*t259 - 0.2222222224e0_dp*t24*t98*t358)*sx + | ^ +Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:67: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't815' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2175:32: + 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 + | ^ +note: 't95' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:544:70: - 2175 | t1832 = t814*t254 - | ^ -Warning: 't814' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:76: + 544 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 + | ^ +Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:62: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't814' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: + 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 + | ^ +note: 't94' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:507:72: - 2099 | + t842 - t1609 - | ^ -Warning: 't813' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:70: + 507 | *t11*t91 + 0.40e1_dp*t382*t384 - 0.20e1_dp*t6*t401 + | ^ +Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:51: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't813' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 + | ^ +note: 't91' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:433:30: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't812' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:64: + 433 | t226 = t225*t90 + | ^ +Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:46: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't812' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2177:32: + 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 + | ^ +note: 't90' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:504:55: - 2177 | t1838 = t811*t202 - | ^ -Warning: 't811' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:58: + 504 | t87 + 0.8000000000e1_dp*t393*t397 + | ^ +Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:35: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't811' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2193:32: + 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 + | ^ +note: 't87' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:559:66: - 2193 | t1891 = t808*t254 - | ^ -Warning: 't808' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:52: + 559 | t525 = 0.120e2_dp*t508*t86 - 0.60e1_dp*t6*t521*t250 + | ^ +Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:18: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't808' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2181:32: + 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 + | ^ +note: 't86' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:606:39: - 2181 | t1850 = t806*t254 - | ^ -Warning: 't806' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:46: + 606 | t669 = 0.1e1_dp/t85/t667 + | ^ +Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:95: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't806' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2189:32: + 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & + | ^ +note: 't85' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:605:28: - 2189 | t1870 = t804*t254 - | ^ -Warning: 't804' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:40: + 605 | t667 = t84**2 + | ^ +Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:78: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't804' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2194:32: + 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & + | ^ +note: 't84' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:390:31: - 2194 | t1893 = t803*t305 - | ^ -Warning: 't803' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:34: + 390 | t140 = t8*my_rho + | ^ +Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:67: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't803' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2183:32: + 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & + | ^ +note: 't8' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:624:67: - 2183 | t1858 = t802*t142 - | ^ -Warning: 't802' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:28: + 624 | *t128*t43*t677 - 0.2666666667e1_dp*t42*pi*t79 + | ^ +Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:51: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't802' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1448:30: + 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & + | ^ +note: 't79' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:446:30: - 1448 | t245 = t80*t225 + 446 | t255 = t77*t254 | ^ -Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:22: +Warning: 't77' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:46: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't80' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1924:47: + 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & + | ^ +note: 't77' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - 1924 | t1099 = t8**(-0.1666666667e1_dp) - | ^ -Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:17: + 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:35: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't8' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2225:34: + 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & + | ^ +note: 't76' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:601:28: - 2225 | *t136*t1986 - | ^ -Warning: 't799' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:13: + 601 | t639 = t75**2 + | ^ +Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:30: - 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & - | ^ -note: 't799' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2225:34: + 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & + | ^ +note: 't75' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:507:72: - 2225 | *t136*t1986 - | ^ -Warning: 't796' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:97: + 507 | *t11*t91 + 0.40e1_dp*t382*t384 - 0.20e1_dp*t6*t401 + | ^ +Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:90: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & - | ^ -note: 't796' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2243:80: + 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & + | ^ +note: 't72' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - 2243 | 0.3e1_dp*t1765 + 0.120e2_dp*t1858*t327 - 0.120e2_dp*t1776 - | ^ -Warning: 't793' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:91: + 673 | *t244*my_ndrho/t657/t7*t669) + | ^ +Warning: 't71' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:79: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & - | ^ -note: 't793' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2219:33: + 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & + | ^ +note: 't71' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:351:30: - 2219 | t1975 = t1697*t789 - | ^ -Warning: 't789' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:85: + 351 | t69 = t7*my_rho + | ^ +Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:74: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & - | ^ -note: 't789' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & + | ^ +note: 't7' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:613:63: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't784' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:73: + 613 | /t69*t669) + | ^ +Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:70: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & - | ^ -note: 't784' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2176:32: + 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & + | ^ +note: 't69' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: - 2176 | t1836 = t732*t783 - | ^ -Warning: 't783' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:67: + 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:59: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & - | ^ -note: 't783' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & + | ^ +note: 't68' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't782' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:61: + 784 | t98*t1400 + | ^ +Warning: 't64' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:18: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & - | ^ -note: 't782' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2154:38: + 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & + | ^ +note: 't64' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:403:74: - 2154 | t1783 = 0.160e2_dp*t780 - | ^ -Warning: 't780' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:55: + 403 | 0.2222222224e0_dp*t24*t98*t155)*sx + | ^ +Warning: 't60' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:51: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & - | ^ -note: 't780' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2212:29: + 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & + | ^ +note: 't60' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - 2212 | *t1776 - | ^ -Warning: 't779' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:49: + 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) + | ^ +Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:46: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & - | ^ -note: 't779' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2212:29: + 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & + | ^ +note: 't6' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:729:31: - 2212 | *t1776 - | ^ -Warning: 't778' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:43: + 729 | t1153 = t27*t590 + | ^ +Warning: 't590' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:42: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & - | ^ -note: 't778' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2212:29: + 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & + | ^ +note: 't590' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: - 2212 | *t1776 - | ^ -Warning: 't777' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:37: + 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:36: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & - | ^ -note: 't777' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2155:39: + 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & + | ^ +note: 't59' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - 2155 | t1785 = 0.2400e2_dp*t774 - | ^ -Warning: 't774' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:31: + 775 | *t36*t38*t1396 + | ^ +Warning: 't586' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:31: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & | ^ -note: 't774' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2202:58: +note: 't586' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: - 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 - | ^ -Warning: 't773' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:25: + 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't580' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:25: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & | ^ -note: 't773' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2202:58: +note: 't580' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 - | ^ -Warning: 't772' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:19: + 775 | *t36*t38*t1396 + | ^ +Warning: 't576' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:19: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & | ^ -note: 't772' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2152:64: +note: 't576' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - 2152 | *t125*t340*t309 + t1775 - 0.40e1_dp*t1776 - | ^ -Warning: 't771' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:13: + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't575' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:13: - 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & | ^ -note: 't771' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2156:37: +note: 't575' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - 2156 | t1786 = 0.80e1_dp*t769 + 775 | *t36*t38*t1396 | ^ -Warning: 't769' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:91: +Warning: 't574' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:96: - 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & - | ^ -note: 't769' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2100:37: + 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & + | ^ +note: 't574' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: - 2100 | t1611 = 0.80e1_dp*t767 - | ^ -Warning: 't767' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:85: + 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't573' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:90: - 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & - | ^ -note: 't767' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2092:36: + 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & + | ^ +note: 't573' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - 2092 | t1603 = 0.2e1_dp*t766 - | ^ -Warning: 't766' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:79: + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't572' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:84: - 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & - | ^ -note: 't766' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & + | ^ +note: 't572' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't764' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:73: + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't571' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:78: - 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & - | ^ -note: 't764' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & + | ^ +note: 't571' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't762' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:61: + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't570' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:72: - 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & - | ^ -note: 't762' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2096:38: + 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & + | ^ +note: 't570' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - 2096 | t1609 = 0.160e2_dp*t759 - | ^ -Warning: 't759' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:55: + 775 | *t36*t38*t1396 + | ^ +Warning: 't566' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:66: - 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & - | ^ -note: 't759' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2202:58: + 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & + | ^ +note: 't566' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 - | ^ -Warning: 't758' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:49: + 775 | *t36*t38*t1396 + | ^ +Warning: 't562' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:60: - 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & - | ^ -note: 't758' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2188:64: + 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & + | ^ +note: 't562' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:400:26: - 2188 | *t133*t90*t91*t789 + 0.80e1_dp*t1671*t327 - | ^ -Warning: 't757' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:43: + 400 | t151 + | ^ +Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:54: - 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & - | ^ -note: 't757' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2138:52: + 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & + | ^ +note: 't55' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - 2138 | t1730 = 0.160e2_dp*t755*t756*t252*t91 - | ^ -Warning: 't756' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:37: + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't539' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:49: - 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & - | ^ -note: 't756' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2188:64: + 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & + | ^ +note: 't539' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - 2188 | *t133*t90*t91*t789 + 0.80e1_dp*t1671*t327 - | ^ -Warning: 't755' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:31: + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't537' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:43: - 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & - | ^ -note: 't755' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2091:39: + 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & + | ^ +note: 't537' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - 2091 | t1602 = 0.2400e2_dp*t753 - | ^ -Warning: 't753' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:25: + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't536' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:37: - 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & - | ^ -note: 't753' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2212:29: + 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & + | ^ +note: 't536' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - 2212 | *t1776 - | ^ -Warning: 't752' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:19: + 784 | t98*t1400 + | ^ +Warning: 't530' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:19: - 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & + 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ -note: 't752' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2146:49: +note: 't530' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:817:44: - 2146 | t1768 = 0.2400e2_dp*t750*t253*t751 - | ^ -Warning: 't751' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:13: + 817 | *sx + | ^ +Warning: 't529' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:13: - 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & + 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & | ^ -note: 't751' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2202:58: +note: 't529' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 - | ^ -Warning: 't750' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:94: + 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't526' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:93: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & - | ^ -note: 't750' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1444:30: + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & + | ^ +note: 't526' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - 1444 | t239 = t75*t212 - | ^ -Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:88: + 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't525' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:87: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & - | ^ -note: 't75' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2095:37: + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & + | ^ +note: 't525' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - 2095 | t1606 = 0.80e1_dp*t748 - | ^ -Warning: 't748' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:83: + 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't521' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:81: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & - | ^ -note: 't748' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2093:37: + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & + | ^ +note: 't521' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:415:59: - 2093 | t1604 = 0.80e1_dp*t746 - | ^ -Warning: 't746' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:77: + 415 | *t52 - 0.5000000001e0_dp*t41*t172*t46 + | ^ +Warning: 't52' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:75: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & - | ^ -note: 't746' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2094:36: + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & + | ^ +note: 't52' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:598:38: - 2094 | t1605 = 0.2e1_dp*t745 - | ^ -Warning: 't745' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:71: + 598 | t624 = 0.1e1_dp/t8/t519 + | ^ +Warning: 't519' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:70: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & - | ^ -note: 't745' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2143:41: + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & + | ^ +note: 't519' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - 2143 | t1754 = 0.2e1_dp*t744*t254 - | ^ -Warning: 't744' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:65: + 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't514' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:64: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & - | ^ -note: 't744' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & + | ^ +note: 't514' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - 2249 | t2048)*t2)*sc - | ^ -Warning: 't743' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:59: + 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) + | ^ +Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:58: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & - | ^ -note: 't743' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2153:36: + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & + | ^ +note: 't513' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:475:33: - 2153 | t1782 = 0.2e1_dp*t742 - | ^ -Warning: 't742' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:53: + 475 | t339 = t48*t10*t51 + | ^ +Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:52: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & - | ^ -note: 't742' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2144:41: + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & + | ^ +note: 't51' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - 2144 | t1764 = 0.2e1_dp*t741*t202 - | ^ -Warning: 't741' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:47: + 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't508' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:47: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ -note: 't741' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2032:40: +note: 't508' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - 2032 | t1469 = t74**(-0.40e1_dp) - | ^ -Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:41: + 784 | t98*t1400 + | ^ +Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:41: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ -note: 't74' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2207:29: +note: 't505' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - 2207 | *t1094 + 784 | t98*t1400 + | ^ +Warning: 't502' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:35: + + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & + | ^ +note: 't502' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:817:44: + + 817 | *sx + | ^ +Warning: 't501' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:29: + + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & | ^ -Warning: 't735' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:36: +note: 't501' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:613:63: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & - | ^ -note: 't735' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2103:42: + 613 | /t69*t669) + | ^ +Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:23: - 2103 | t1620 = 0.80e1_dp*t733*t254 - | ^ -Warning: 't733' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:30: + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & + | ^ +note: 't5' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:662:30: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + 662 | t857 = t27*t496 | ^ -note: 't733' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2243:80: +Warning: 't496' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:19: - 2243 | 0.3e1_dp*t1765 + 0.120e2_dp*t1858*t327 - 0.120e2_dp*t1776 - | ^ -Warning: 't732' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:24: + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & + | ^ +note: 't496' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:716:76: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & - | ^ -note: 't732' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2118:42: + 716 | + t1136) + | ^ +Warning: 't492' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:13: - 2118 | t1666 = 0.80e1_dp*t730*t254 - | ^ -Warning: 't730' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:18: + 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & + | ^ +note: 't492' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & - | ^ -note: 't730' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1666:64: + 687 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:96: - 1666 | *t583*t548)*t86)*t91 - | ^ -Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:12: + 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & + | ^ +note: 't49' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: - 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & - | ^ -note: 't73' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2147:41: + 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:91: - 2147 | t1775 = 0.2e1_dp*t729*t305 - | ^ -Warning: 't729' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:93: + 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & + | ^ +note: 't489' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: - 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & - | ^ -note: 't729' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2120:32: + 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't486' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:85: - 2120 | t1671 = t728*t142 - | ^ -Warning: 't728' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:87: + 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & + | ^ +note: 't486' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: - 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & - | ^ -note: 't728' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2173:33: + 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't482' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:79: - 2173 | *t725*t371 - | ^ -Warning: 't725' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:81: + 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & + | ^ +note: 't482' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: - 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & - | ^ -note: 't725' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2173:33: + 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:68: - 2173 | *t725*t371 - | ^ -Warning: 't722' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:75: + 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & + | ^ +note: 't479' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:701:68: - 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & - | ^ -note: 't722' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2173:33: + 701 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 + | ^ +Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:62: - 2173 | *t725*t371 - | ^ -Warning: 't719' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:69: + 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & + | ^ +note: 't478' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: - 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & - | ^ -note: 't719' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2173:33: + 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't473' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:56: - 2173 | *t725*t371 - | ^ -Warning: 't716' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:63: + 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & + | ^ +note: 't473' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:701:68: - 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & + 701 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 + | ^ +Warning: 't470' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:50: + + 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & + | ^ +note: 't470' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:637:40: + + 637 | REAL(t46, KIND=dp) + | ^ +Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:44: + + 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & + | ^ +note: 't47' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: + + 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 | ^ -note: 't716' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1841:35: +Warning: 't467' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:39: - 1841 | t857 = 0.3e1_dp*t705 - | ^ -Warning: 't705' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:33: + 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & + | ^ +note: 't467' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't466' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:33: + + 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ -note: 't705' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2129:32: +note: 't466' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: - 2129 | t1696 = t316*t704 - | ^ -Warning: 't704' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:27: + 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't465' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:27: - 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & + 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & | ^ -note: 't704' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: +note: 't465' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: - 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't464' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:71: + + 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ -Warning: 't697' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:66: +note: 't464' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: - 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 - | ^ -note: 't697' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: + 708 | t41*t328*t466 + | ^ +Warning: 't463' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:65: - 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 - | ^ -Warning: 't696' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:60: + 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 + | ^ +note: 't463' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: - 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 - | ^ -note: 't696' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: + 708 | t41*t328*t466 + | ^ +Warning: 't462' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:59: - 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 - | ^ -Warning: 't691' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:54: + 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 + | ^ +note: 't462' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: - 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 - | ^ -note: 't691' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: + 687 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't460' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:53: - 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 - | ^ -Warning: 't688' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:48: + 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 + | ^ +note: 't460' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:415:59: - 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 - | ^ -note: 't688' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: + 415 | *t52 - 0.5000000001e0_dp*t41*t172*t46 + | ^ +Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:47: - 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 - | ^ -Warning: 't687' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:42: + 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 + | ^ +note: 't46' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: - 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 + 687 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't457' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:42: + + 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ -note: 't687' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: +note: 't457' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: - 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 - | ^ -Warning: 't683' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:36: + 687 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't455' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:36: - 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 + 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ -note: 't683' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: +note: 't455' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:745:57: - 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 - | ^ -Warning: 't682' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:30: + 745 | + 0.5999999999e1_dp*t128*t132*t529 + | ^ +Warning: 't452' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:30: - 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 + 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ -note: 't682' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: +note: 't452' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 - | ^ -Warning: 't681' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:24: + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't451' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:24: - 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 + 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ -note: 't681' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: +note: 't451' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:370:49: - 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 - | ^ -Warning: 't679' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:13: + 370 | t103 = EXP(-0.9000000000e1_dp*t44) + | ^ +Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:18: - 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 + 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 + | ^ +note: 't44' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: + + 775 | *t36*t38*t1396 + | ^ +Warning: 't435' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:13: + + 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 | ^ -note: 't679' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: +note: 't435' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:384:34: - 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + 384 | t130 = t128*t43*t94 + | ^ +Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:93: + + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & + | ^ +note: 't43' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: + + 775 | *t36*t38*t1396 + | ^ +Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:88: + + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & + | ^ +note: 't429' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: + + 687 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:82: + + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & + | ^ +note: 't428' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:386:30: + + 386 | t133 = t42*t132 + | ^ +Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:76: + + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & + | ^ +note: 't42' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: + + 775 | *t36*t38*t1396 + | ^ +Warning: 't418' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:71: + + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ -Warning: 't678' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:96: +note: 't418' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: - 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & - | ^ -note: 't678' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1971:47: + 687 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:65: - 1971 | *t674*t1171 - t291*t1181 - | ^ -Warning: 't674' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:90: + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & + | ^ +note: 't417' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & - | ^ -note: 't674' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1971:47: + 775 | *t36*t38*t1396 + | ^ +Warning: 't413' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:59: - 1971 | *t674*t1171 - t291*t1181 - | ^ -Warning: 't667' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:84: + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & + | ^ +note: 't413' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:535:30: - 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & - | ^ -note: 't667' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1971:47: + 535 | t489 = t41*t135 + | ^ +Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:47: - 1971 | *t674*t1171 - t291*t1181 + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & | ^ -Warning: 't666' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:78: +note: 't41' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: - 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & - | ^ -note: 't666' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1960:32: + 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't408' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:42: - 1960 | t1238 = t874*t661 - | ^ -Warning: 't661' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:66: + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & + | ^ +note: 't408' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: - 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & - | ^ -note: 't661' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1964:43: + 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:36: - 1964 | t1252 = t865/t659/t282*t1250 - | ^ -Warning: 't659' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:60: + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & + | ^ +note: 't405' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & - | ^ -note: 't659' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 784 | t98*t1400 + | ^ +Warning: 't404' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:30: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't658' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:54: + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & + | ^ +note: 't404' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & - | ^ -note: 't658' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) + | ^ +Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:24: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't657' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:48: + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & + | ^ +note: 't401' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & - | ^ -note: 't657' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1961:30: + 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) + | ^ +Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:18: - 1961 | t1244 = t654**2 + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & + | ^ +note: 't400' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:383:30: + + 383 | t128 = t40*t127 | ^ -Warning: 't654' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:36: +Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:12: - 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & - | ^ -note: 't654' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1639:39: + 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & + | ^ +note: 't40' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - 1639 | t542 = 0.1e1_dp/t540/t65 - | ^ -Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:24: + 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) + | ^ +Warning: 't397' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:93: - 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & - | ^ -note: 't65' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + | ^ +note: 't397' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't648' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:19: + 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't393' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:87: - 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & - | ^ -note: 't648' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + | ^ +note: 't393' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:389:29: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't644' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:96: + 389 | t137 = t39*t94 + | ^ +Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:81: - 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & - | ^ -note: 't644' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + | ^ +note: 't39' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't643' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:90: + 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) + | ^ +Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:76: - 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & - | ^ -note: 't643' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + | ^ +note: 't384' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't636' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:73: + 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) + | ^ +Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:70: - 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & - | ^ -note: 't636' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + | ^ +note: 't383' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't635' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:67: + 673 | *t244*my_ndrho/t657/t7*t669) + | ^ +Warning: 't382' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:64: - 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & - | ^ -note: 't635' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + | ^ +note: 't382' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:488:68: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't634' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:61: + 488 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 + | ^ +Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:58: - 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & - | ^ -note: 't634' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + | ^ +note: 't38' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't631' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:55: + 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) + | ^ +Warning: 't377' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:53: - 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & - | ^ -note: 't631' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + | ^ +note: 't377' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't630' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:49: + 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:47: - 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & - | ^ -note: 't630' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + | ^ +note: 't372' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:517:30: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't627' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:43: + 517 | t435 = t37*t196 + | ^ +Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:41: - 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & - | ^ -note: 't627' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1953:63: + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + | ^ +note: 't37' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - 1953 | *t622*t874 - 0.9531842928e0_dp*t266*t887 - | ^ -Warning: 't622' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:37: + 784 | t98*t1400 + | ^ +Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:36: - 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & - | ^ -note: 't622' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1950:32: + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + | ^ +note: 't368' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - 1950 | t1168 = t619*t269 + 784 | t98*t1400 | ^ -Warning: 't619' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:31: +Warning: 't365' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:30: - 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & - | ^ -note: 't619' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + | ^ +note: 't365' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't618' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:25: + 784 | t98*t1400 + | ^ +Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:24: - 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & - | ^ -note: 't618' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + | ^ +note: 't36' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:594:30: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't617' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:19: + 594 | t601 = t27*t358 + | ^ +Warning: 't358' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:19: - 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ -note: 't617' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: +note: 't358' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't611' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:13: + 652 | + 0.3333333334e0_dp*t36*t38*t838 + | ^ +Warning: 't354' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:13: - 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & | ^ -note: 't611' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: +note: 't354' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't610' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:93: + 708 | t41*t328*t466 + | ^ +Warning: 't351' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:96: - 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & - | ^ -note: 't610' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1426:30: + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & + | ^ +note: 't351' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: - 1426 | t208 = t149*t61 - | ^ -Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:87: + 708 | t41*t328*t466 + | ^ +Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:90: - 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & - | ^ -note: 't61' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1944:32: + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & + | ^ +note: 't347' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:637:40: - 1944 | t1151 = t607*t874 - | ^ -Warning: 't607' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:76: + 637 | REAL(t46, KIND=dp) + | ^ +Warning: 't346' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:84: - 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & - | ^ -note: 't607' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & + | ^ +note: 't346' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: - 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 - | ^ -Warning: 't606' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:70: + 708 | t41*t328*t466 + | ^ +Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:78: - 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & - | ^ -note: 't606' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2089:105: + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & + | ^ +note: 't343' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: - 2089 | t1599)*t2)*sc - | ^ -Warning: 't605' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:64: + 708 | t41*t328*t466 + | ^ +Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:67: - 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & - | ^ -note: 't605' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2137:80: + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & + | ^ +note: 't339' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:701:68: - 2137 | + 0.2e1_dp*t1580 - 0.40e1_dp*t1582 + 0.80e1_dp*t1671*t257 - | ^ -Warning: 't604' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:58: + 701 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 + | ^ +Warning: 't335' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:61: - 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & - | ^ -note: 't604' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2215:50: + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & + | ^ +note: 't335' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:637:40: - 2215 | - t820 + t486 + t603 - t822 - | ^ -Warning: 't603' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:52: + 637 | REAL(t46, KIND=dp) + | ^ +Warning: 't330' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:55: - 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & - | ^ -note: 't603' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & + | ^ +note: 't330' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: - 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 - | ^ -Warning: 't602' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:46: + 708 | t41*t328*t466 + | ^ +Warning: 't328' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:49: - 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & - | ^ -note: 't602' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2102:42: + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & + | ^ +note: 't328' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: - 2102 | t1615 = 0.80e1_dp*t732*t601 - | ^ -Warning: 't601' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:40: + 708 | t41*t328*t466 + | ^ +Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:43: - 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & - | ^ -note: 't601' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & + | ^ +note: 't326' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: - 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 - | ^ -Warning: 't600' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:34: + 652 | + 0.3333333334e0_dp*t36*t38*t838 + | ^ +Warning: 't325' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:37: - 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & - | ^ -note: 't600' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1451:70: + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & + | ^ +note: 't325' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:694:38: - 1451 | t73*(t243*t60 + 0.3177280975e0_dp*t246*t232)*t86 - | ^ -Warning: 't60' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:28: + 694 | *t128*t323*t172 + | ^ +Warning: 't323' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:31: - 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & - | ^ -note: 't60' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2089:105: + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & + | ^ +note: 't323' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: - 2089 | t1599)*t2)*sc - | ^ -Warning: 't599' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:19: + 652 | + 0.3333333334e0_dp*t36*t38*t838 + | ^ +Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:25: - 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & + | ^ +note: 't321' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: + + 652 | + 0.3333333334e0_dp*t36*t38*t838 + | ^ +Warning: 't319' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:19: + + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ -note: 't599' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2137:80: +note: 't319' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: - 2137 | + 0.2e1_dp*t1580 - 0.40e1_dp*t1582 + 0.80e1_dp*t1671*t257 - | ^ -Warning: 't598' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:13: + 652 | + 0.3333333334e0_dp*t36*t38*t838 + | ^ +Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:13: - 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & | ^ -note: 't598' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2215:50: +note: 't316' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - 2215 | - t820 + t486 + t603 - t822 - | ^ -Warning: 't597' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:96: + 775 | *t36*t38*t1396 + | ^ +Warning: 't313' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:97: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & - | ^ -note: 't597' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & + | ^ +note: 't313' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: - 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 - | ^ -Warning: 't596' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:90: + 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 + | ^ +Warning: 't312' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:91: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & - | ^ -note: 't596' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & + | ^ +note: 't312' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:457:31: - 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 - | ^ -Warning: 't595' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:84: + 457 | *t30*t281 + | ^ +Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:79: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & - | ^ -note: 't595' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2089:105: + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & + | ^ +note: 't31' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:716:76: - 2089 | t1599)*t2)*sc - | ^ -Warning: 't594' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:78: + 716 | + t1136) + | ^ +Warning: 't304' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:74: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & - | ^ -note: 't594' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & + | ^ +note: 't304' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:375:26: - 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 - | ^ -Warning: 't593' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:72: + 375 | t109 + | ^ +Warning: 't30' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:68: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & - | ^ -note: 't593' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1840:35: + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & + | ^ +note: 't30' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:460:28: - 1840 | t851 = 0.3e1_dp*t592 - | ^ -Warning: 't592' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:66: + 460 | t293 = t3*t55 + | ^ +Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:63: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & - | ^ -note: 't592' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2148:32: + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & + | ^ +note: 't3' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - 2148 | t1776 = t317*t591 - | ^ -Warning: 't591' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:60: + 775 | *t36*t38*t1396 + | ^ +Warning: 't297' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:59: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & - | ^ -note: 't591' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & + | ^ +note: 't297' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't583' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:54: + 775 | *t36*t38*t1396 + | ^ +Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:53: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & - | ^ -note: 't583' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & + | ^ +note: 't293' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:425:38: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't582' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:48: + 425 | t211 = my_rho*t29*omega + | ^ +Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:47: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & - | ^ -note: 't582' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & + | ^ +note: 't29' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't577' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:42: + 775 | *t36*t38*t1396 + | ^ +Warning: 't289' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:42: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ -note: 't577' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: +note: 't289' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't574' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:36: + 687 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't285' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:36: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ -note: 't574' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: +note: 't285' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't573' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:30: + 652 | + 0.3333333334e0_dp*t36*t38*t838 + | ^ +Warning: 't284' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:30: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ -note: 't573' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1454:30: +note: 't284' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: - 1454 | t255 = t57*t254 - | ^ -Warning: 't57' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:24: + 687 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't281' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:24: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ -note: 't57' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: +note: 't281' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:372:30: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't569' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:19: + 372 | t105 = t28*t104 + | ^ +Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:18: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & - | ^ -note: 't569' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & + | ^ +note: 't28' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't568' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:13: + 775 | *t36*t38*t1396 + | ^ +Warning: 't271' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:13: - 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & | ^ -note: 't568' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't567' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:95: - - 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & - | ^ -note: 't567' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: +note: 't271' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't565' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:89: + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't270' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:94: - 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & - | ^ -note: 't565' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: + 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & + | ^ +note: 't270' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't564' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:83: + 687 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't265' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:83: - 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ -note: 't564' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2031:47: +note: 't265' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: - 2031 | *t560*t1394 - t239*t1404 - | ^ -Warning: 't560' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:77: + 687 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't264' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:77: - 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ -note: 't560' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1422:30: - - 1422 | t204 = t140*t56 - | ^ -Warning: 't56' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:71: - - 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & - | ^ -note: 't56' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2031:47: +note: 't264' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: - 2031 | *t560*t1394 - t239*t1404 - | ^ -Warning: 't553' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:66: + 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 + | ^ +Warning: 't259' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:66: - 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ -note: 't553' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2031:47: +note: 't259' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: - 2031 | *t560*t1394 - t239*t1404 - | ^ -Warning: 't552' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:60: + 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:60: - 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ -note: 't552' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1508:56: +note: 't258' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - 1508 | t55 + t93 + t127)*sc - | ^ -Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:54: + 673 | *t244*my_ndrho/t657/t7*t669) + | ^ +Warning: 't255' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:54: - 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ -note: 't55' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2039:32: - - 2039 | t1510 = t874*t547 - | ^ -Warning: 't547' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:43: +note: 't255' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & - | ^ -note: 't547' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2043:43: + 673 | *t244*my_ndrho/t657/t7*t669) + | ^ +Warning: 't254' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:48: - 2043 | t1524 = t865/t545/t230*t1522 - | ^ -Warning: 't545' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:37: + 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & + | ^ +note: 't254' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & - | ^ -note: 't545' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 673 | *t244*my_ndrho/t657/t7*t669) + | ^ +Warning: 't251' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:42: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't544' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:31: + 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & + | ^ +note: 't251' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & - | ^ -note: 't544' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:36: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't543' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:25: + 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & + | ^ +note: 't250' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & - | ^ -note: 't543' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2040:30: + 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) + | ^ +Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:30: - 2040 | t1516 = t540**2 + 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & | ^ -Warning: 't540' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:13: +note: 't245' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & - | ^ -note: 't540' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1386:30: + 673 | *t244*my_ndrho/t657/t7*t669) + | ^ +Warning: 't244' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:24: - 1386 | t148 = t147*t54 - | ^ -Warning: 't54' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:92: + 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & + | ^ +note: 't244' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & - | ^ -note: 't54' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 673 | *t244*my_ndrho/t657/t7*t669) + | ^ +Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:18: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't534' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:81: + 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & + | ^ +note: 't241' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: - 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & - | ^ -note: 't534' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 + | ^ +Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:12: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't530' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:69: + 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & + | ^ +note: 't24' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & - | ^ -note: 't530' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 673 | *t244*my_ndrho/t657/t7*t669) + | ^ +Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:97: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't529' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:63: + 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & + | ^ +note: 't237' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & - | ^ -note: 't529' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 673 | *t244*my_ndrho/t657/t7*t669) + | ^ +Warning: 't233' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:91: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't522' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:51: + 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & + | ^ +note: 't233' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & - | ^ -note: 't522' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 673 | *t244*my_ndrho/t657/t7*t669) + | ^ +Warning: 't232' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:85: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't521' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:45: + 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & + | ^ +note: 't232' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & - | ^ -note: 't521' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't230' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:73: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ -Warning: 't520' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:39: +note: 't230' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:371:34: - 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & - | ^ -note: 't520' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 371 | t104 = 0.1e1_dp/t23 + | ^ +Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:67: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't517' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:33: + 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & + | ^ +note: 't23' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & + 673 | *t244*my_ndrho/t657/t7*t669) + | ^ +Warning: 't226' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:62: + + 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & + | ^ +note: 't226' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: + + 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) + | ^ +Warning: 't225' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:56: + + 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & + | ^ +note: 't225' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: + + 673 | *t244*my_ndrho/t657/t7*t669) + | ^ +Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:50: + + 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & + | ^ +note: 't222' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:599:30: + + 599 | t628 = t221*t76 + | ^ +Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:44: + + 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & + | ^ +note: 't221' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:350:37: + + 350 | t68 = my_rho*t22*omega + | ^ +Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:38: + + 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & + | ^ +note: 't22' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:613:63: + + 613 | /t69*t669) + | ^ +Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:33: + + 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ -note: 't517' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: +note: 't219' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't516' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:27: + 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 + | ^ +Warning: 't216' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:27: - 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & + 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & | ^ -note: 't516' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: +note: 't216' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:70: + 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 + | ^ +Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:70: - 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ -note: 't513' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1601:54: +note: 't213' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: - 1601 | t473*t435)*t51 - | ^ -Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:64: + 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:64: - 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ -note: 't51' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2024:63: +note: 't212' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: - 2024 | *t508*t874 - 0.9531842928e0_dp*t214*t887 - | ^ -Warning: 't508' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:59: + 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) + | ^ +Warning: 't211' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:58: - 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 - | ^ -note: 't508' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2021:32: + 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 + | ^ +note: 't211' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:463:30: - 2021 | t1391 = t505*t217 - | ^ -Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:53: + 463 | t311 = t126*t21 + | ^ +Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:52: - 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 - | ^ -note: 't505' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 + | ^ +note: 't21' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't504' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:47: + 784 | t98*t1400 + | ^ +Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:47: - 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ -note: 't504' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: +note: 't207' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:494:30: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't503' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:41: + 494 | t365 = t27*t200 + | ^ +Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:41: - 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ -note: 't503' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1920:47: +note: 't200' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:577:29: - 1920 | t1088 = t5**(-0.1666666667e1_dp) - | ^ -Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:35: + 577 | t576 = t2*t501 + | ^ +Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:35: - 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ -note: 't5' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: +note: 't2' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:544:70: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't497' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:31: + 544 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 + | ^ +Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:31: - 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ -note: 't497' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: +note: 't196' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't496' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:25: + 708 | t41*t328*t466 + | ^ +Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:25: - 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ -note: 't496' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2015:32: +note: 't190' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - 2015 | t1374 = t493*t874 - | ^ -Warning: 't493' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:13: + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:19: - 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 + | ^ +note: 't186' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: + + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:13: + + 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 | ^ -note: 't493' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2165:60: +note: 't185' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:407:59: - 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 - | ^ -Warning: 't492' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:96: + 407 | t172 = 0.40e1_dp*t11*t18 - 0.20e1_dp*t6*t169 + | ^ +Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:96: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ -note: 't492' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: +note: 't18' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - 2099 | + t842 - t1609 - | ^ -Warning: 't491' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:90: + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:91: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & - | ^ -note: 't491' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: + 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & + | ^ +note: 't177' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:549:69: - 2099 | + t842 - t1609 - | ^ -Warning: 't490' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:84: + 549 | *t24*t98*t496)*sx + | ^ +Warning: 't173' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:79: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & - | ^ -note: 't490' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2089:105: + 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & + | ^ +note: 't173' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:586:35: - 2089 | t1599)*t2)*sc - | ^ -Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:73: + 586 | *t36*t38*t586 + | ^ +Warning: 't172' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:73: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ -note: 't489' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: +note: 't172' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:353:28: - 2099 | + t842 - t1609 - | ^ -Warning: 't488' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:67: + 353 | t72 = t71*t17 + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:67: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ -note: 't488' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2089:105: +note: 't17' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:562:41: - 2089 | t1599)*t2)*sc - | ^ -Warning: 't487' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:61: + 562 | - 0.20e1_dp*t6*t526 + | ^ +Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:62: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & - | ^ -note: 't487' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2215:50: + 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & + | ^ +note: 't169' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:497:31: - 2215 | - t820 + t486 + t603 - t822 + 497 | t377 = t225*t168 + | ^ +Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:56: + + 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & + | ^ +note: 't168' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:434:38: + + 434 | t230 = 0.1e1_dp/t75/t16 + | ^ +Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:50: + + 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & | ^ -Warning: 't486' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:55: +note: 't16' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:424:30: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & - | ^ -note: 't486' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: + 424 | t207 = t27*t155 + | ^ +Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:38: - 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 - | ^ -Warning: 't485' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:49: + 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & + | ^ +note: 't155' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:488:68: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & - | ^ -note: 't485' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: + 488 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 + | ^ +Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:32: - 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 - | ^ -Warning: 't484' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:43: + 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & + | ^ +note: 't151' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:539:82: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & - | ^ -note: 't484' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2089:105: + 539 | - 0.5555555558e-1_dp*t146*t486 - 0.5000000001e0_dp*t489*t466 + | ^ +Warning: 't148' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:26: - 2089 | t1599)*t2)*sc - | ^ -Warning: 't483' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:37: + 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & + | ^ +note: 't148' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & - | ^ -note: 't483' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: + 708 | t41*t328*t466 + | ^ +Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:13: - 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 - | ^ -Warning: 't482' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:31: + 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & + | ^ +note: 't147' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & - | ^ -note: 't482' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2072:32: + 708 | t41*t328*t466 + | ^ +Warning: 't146' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:270:87: - 2072 | t1576 = t481*t254 - | ^ -Warning: 't481' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:25: + 270 | t1370, t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, & + | ^ +note: 't146' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:539:82: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & - | ^ -note: 't481' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1839:35: + 539 | - 0.5555555558e-1_dp*t146*t486 - 0.5000000001e0_dp*t489*t466 + | ^ +Warning: 't143' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:270:67: - 1839 | t842 = 0.3e1_dp*t480 + 270 | t1370, t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, & + | ^ +note: 't143' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:476:35: + + 476 | t343 = t141*t135*t46 | ^ -Warning: 't480' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:19: +Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:270:54: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & - | ^ -note: 't480' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2145:32: + 270 | t1370, t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, & + | ^ +note: 't141' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - 2145 | t1765 = t320*t479 - | ^ -Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:13: + 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) + | ^ +Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:270:27: - 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & - | ^ -note: 't479' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: + 270 | t1370, t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, & + | ^ +note: 't140' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:637:40: - 1900 | *t45*t1020*t984*t1027 - | ^ -Warning: 't473' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:96: + 637 | REAL(t46, KIND=dp) + | ^ +Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:96: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & | ^ -note: 't473' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: +note: 't137' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:701:68: - 1900 | *t45*t1020*t984*t1027 - | ^ -Warning: 't472' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:90: + 701 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 + | ^ +Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:90: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & | ^ -note: 't472' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: +note: 't136' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:535:30: - 1900 | *t45*t1020*t984*t1027 - | ^ -Warning: 't467' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:84: + 535 | t489 = t41*t135 + | ^ +Warning: 't135' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:84: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & | ^ -note: 't467' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: - - 1900 | *t45*t1020*t984*t1027 - | ^ -Warning: 't464' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:78: - - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & - | ^ -note: 't464' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: +note: 't135' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:450:69: - 1900 | *t45*t1020*t984*t1027 - | ^ -Warning: 't463' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:72: + 450 | t264 = 0.9000000000e1_dp*t130 - 0.6000000000e1_dp*t133 + | ^ +Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:57: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & - | ^ -note: 't463' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: + 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & + | ^ +note: 't133' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:745:57: - 1900 | *t45*t1020*t984*t1027 - | ^ -Warning: 't459' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:66: + 745 | + 0.5999999999e1_dp*t128*t132*t529 + | ^ +Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:51: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & - | ^ -note: 't459' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: + 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & + | ^ +note: 't132' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:450:69: - 1900 | *t45*t1020*t984*t1027 - | ^ -Warning: 't458' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:60: + 450 | t264 = 0.9000000000e1_dp*t130 - 0.6000000000e1_dp*t133 + | ^ +Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:45: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & - | ^ -note: 't458' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: + 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & + | ^ +note: 't130' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:468:35: - 1900 | *t45*t1020*t984*t1027 - | ^ -Warning: 't457' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:54: + 468 | t321 = t128*t43*t258 + | ^ +Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:32: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & - | ^ -note: 't457' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: + 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & + | ^ +note: 't128' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:530:30: - 1900 | *t45*t1020*t984*t1027 - | ^ -Warning: 't455' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:48: + 530 | t473 = t94*t127 + | ^ +Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:26: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & - | ^ -note: 't455' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: + 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & + | ^ +note: 't127' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:463:30: - 1900 | *t45*t1020*t984*t1027 - | ^ -Warning: 't454' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:42: + 463 | t311 = t126*t21 + | ^ +Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:20: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & - | ^ -note: 't454' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1876:39: + 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & + | ^ +note: 't126' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:544:70: - 1876 | *t896 - t189*t914 - | ^ -Warning: 't450' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:36: + 544 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 + | ^ +Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:92: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & - | ^ -note: 't450' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1417:30: + 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & + | ^ +note: 't122' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:405:67: - 1417 | t195 = t45*t173 - | ^ -Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:30: + 405 | t168 = 0.60e1_dp*beta*t3*t12 + 0.60e1_dp*t11*t10*t86 + | ^ +Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:86: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & - | ^ -note: 't45' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: + 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & + | ^ +note: 't12' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:488:68: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't447' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:25: + 488 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 + | ^ +Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:81: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & - | ^ -note: 't447' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: + 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & + | ^ +note: 't118' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't444' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:19: + 775 | *t36*t38*t1396 + | ^ +Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:68: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & - | ^ -note: 't444' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1868:31: + 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & + | ^ +note: 't117' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - 1868 | t945 = t443*t873 - | ^ -Warning: 't443' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:13: + 784 | t98*t1400 + | ^ +Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:48: - 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & - | ^ -note: 't443' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1876:39: + 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & + | ^ +note: 't116' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - 1876 | *t896 - t189*t914 - | ^ -Warning: 't440' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:96: + 775 | *t36*t38*t1396 + | ^ +Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:96: - 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & + 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & | ^ -note: 't440' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1876:39: +note: 't113' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: - 1876 | *t896 - t189*t914 - | ^ -Warning: 't439' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:90: + 687 | - 0.1111111111e0_dp*t117*t293*t404 + | ^ +Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:90: - 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & + 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & | ^ -note: 't439' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1885:32: +note: 't112' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - 1885 | t1013 = t874*t434 - | ^ -Warning: 't434' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:78: + 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) + | ^ +Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:77: - 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & - | ^ -note: 't434' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1889:43: + 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & + | ^ +note: 't11' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:515:66: - 1889 | t1027 = t865/t432/t178*t1025 - | ^ -Warning: 't432' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:72: + 515 | *t31*t404 - 0.5000000000e0_dp*t105*t109*t172 + | ^ +Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:65: - 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & - | ^ -note: 't432' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & + | ^ +note: 't109' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:586:35: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't431' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:66: + 586 | *t36*t38*t586 + | ^ +Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:52: - 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & - | ^ -note: 't431' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & + | ^ +note: 't105' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:595:39: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't430' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:60: + 595 | t605 = my_rho*t104*omega + | ^ +Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:39: - 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & - | ^ -note: 't430' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1886:30: + 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & + | ^ +note: 't104' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:586:35: - 1886 | t1019 = t427**2 - | ^ -Warning: 't427' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:48: + 586 | *t36*t38*t586 + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:33: - 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & - | ^ -note: 't427' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & + | ^ +note: 't103' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:405:67: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't421' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:36: + 405 | t168 = 0.60e1_dp*beta*t3*t12 + 0.60e1_dp*t11*t10*t86 + | ^ +Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:266:83: - 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & - | ^ -note: 't421' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 266 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, my_ndrho, my_rho, t1, t10, t100, t1002, & + | ^ +note: 't10' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:417:69: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:19: + 417 | t117*t118*t172 + 0.3333333334e0_dp*t36*t38*t196 + | ^ +Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:266:78: - 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & - | ^ -note: 't417' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 266 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, my_ndrho, my_rho, t1, t10, t100, t1002, & + | ^ +note: 't1' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xbecke88_long_range.mod' due to: xc_xbecke88_long_range.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod cp_array_utils.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_cs1.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_cs1.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod kinds.mod xc_functionals_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_cs1.F xc_cs1.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:18:37 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_cs1.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_cs1.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_cs1.mod' due to: xc_cs1.o /build/reproducible-path/cp2k-8.1/src/xc/xc_cs1.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod kinds.mod xc_functionals_utilities.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xwpbe.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathlib.mod mathconstants.mod kinds.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F xc_xwpbe.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:18:40 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xwpbe.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xwpbe.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5635:90: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't416' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:13: + 5635 | 1.0_dp/Q*(dQrho*dQndrho + d2Qrhondrho) + 1.0_dp/(Q*Q)*dQrho*dQndrho + | ^ +Warning: 'dqrho' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:983:76: - 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & - | ^ -note: 't416' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 983 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & + | ^ +note: 'dqrho' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5671:94: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't409' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:87: + 5671 | 1.0_dp/(Q*Q)*(-Q*dQndrho*dQndrho - Q*d2Qndrhondrho + dQndrho*dQndrho) + | ^ +Warning: 'dqndrho' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:983:69: - 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & - | ^ -note: 't409' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 983 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & + | ^ +note: 'dqndrho' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1416:88: - 1917 | *bp*t1020*t984*t1027 - | ^ + 1416 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t235*t408 - t76*t1073*Clda)*sx0 + | ^ Warning: 't408' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:81: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: - 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & + 1438 | + t403*t1066 + t403*t1069) | ^ -note: 't408' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: +Warning: 't403' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: 't402' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't407' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:75: + 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 + | ^ +Warning: 't399' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: 't398' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: 't396' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: 't395' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: 't393' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1423:41: - 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & - | ^ -note: 't407' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 1423 | *t1094 - t113*t114*t1098 + | ^ +Warning: 't392' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1423:41: Warning: 't389' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't406' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:69: + 1438 | + t403*t1066 + t403*t1069) + | ^ +Warning: 't385' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: 't380' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & - | ^ -note: 't406' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't379' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't371' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't403' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:63: + 1438 | + t403*t1066 + t403*t1069) + | ^ +Warning: 't366' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: 't364' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: 't361' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & - | ^ -note: 't403' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't360' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't357' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't402' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:57: + 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 + | ^ +Warning: 't352' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1423:41: - 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & - | ^ -note: 't402' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1413:30: + 1423 | *t1094 - t113*t114*t1098 + | ^ +Warning: 't350' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: - 1413 | t189 = t40*t155 - | ^ -Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:51: + 1438 | + t403*t1066 + t403*t1069) + | ^ +Warning: 't349' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1423:41: - 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & - | ^ -note: 't40' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1525:35: + 1423 | *t1094 - t113*t114*t1098 + | ^ +Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: - 1525 | t355 = t4**0.20e1_dp - | ^ -Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:46: + 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 + | ^ +Warning: 't346' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: - 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & - | ^ -note: 't4' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 1385 | *t902 - t113*t114*t906 + | ^ +Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1377:25: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't399' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:42: + 1377 | t874 = t342*t190 + | ^ +Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1375:54: - 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & - | ^ -note: 't399' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1865:62: + 1375 | - t76*t865*Clda)*sx0 + | ^ +Warning: 't340' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: - 1865 | *t394*t874 - 0.9531842928e0_dp*t161*t887 - | ^ -Warning: 't394' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:36: + 1438 | + t403*t1066 + t403*t1069) + | ^ +Warning: 't335' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & - | ^ -note: 't394' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2031:47: + 1373 | *t331*t333*t253) + | ^ +Warning: 't334' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't333' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't332' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1400:31: - 2031 | *t560*t1394 - t239*t1404 - | ^ -Warning: 't393' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:30: + 1400 | t1069 = t331*t333*t352 + | ^ +Warning: 't331' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & - | ^ -note: 't393' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1877:39: + 1373 | *t331*t333*t253) + | ^ +Warning: 't330' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1877 | t972 = t39**(-0.40e1_dp) - | ^ -Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:12: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't329' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: - 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & - | ^ -note: 't39' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: + 1438 | + t403*t1066 + t403*t1069) + | ^ +Warning: 't328' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't389' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:95: + 1373 | *t331*t333*t253) + | ^ +Warning: 't327' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: - 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & - | ^ -note: 't389' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1861:49: + 1438 | + t403*t1066 + t403*t1069) + | ^ +Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1861 | t903 = 0.1211413728e1_dp*t388*t873 - | ^ -Warning: 't388' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:89: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't325' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: - 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & - | ^ -note: 't388' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1858:31: + 1396 | *t114*t321*t909 + | ^ +Warning: 't323' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: Warning: 't322' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1350:94: - 1858 | t893 = t385*t164 - | ^ -Warning: 't385' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:83: + 1350 | *t114*t820*t640) - (t113*t114*t321*t681) + | ^ +Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: - 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & - | ^ -note: 't385' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 1396 | *t114*t321*t909 + | ^ +Warning: 't319' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: Warning: 't318' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1350:94: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:77: + 1350 | *t114*t820*t640) - (t113*t114*t321*t681) + | ^ +Warning: 't317' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: - 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & - | ^ -note: 't384' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 + | ^ +Warning: 't315' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1332:30: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:71: + 1332 | t113*t114*t678 + | ^ +Warning: 't314' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: - 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & - | ^ -note: 't383' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2017:32: + 1385 | *t902 - t113*t114*t906 + | ^ +Warning: 't311' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: - 2017 | t1380 = t379*t217 - | ^ -Warning: 't379' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:60: + 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 + | ^ +Warning: 't308' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: Warning: 't307' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: - 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & - | ^ -note: 't379' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 1385 | *t902 - t113*t114*t906 + | ^ +Warning: 't305' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:54: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't301' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & - | ^ -note: 't376' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 1373 | *t331*t333*t253) + | ^ +Warning: 't300' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1334:33: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:48: + 1334 | t759 = 0.1e1_dp/t299/t83 + | ^ +Warning: 't299' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & - | ^ -note: 't375' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2013:32: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't297' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't294' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 2013 | t1371 = t372*t217 - | ^ -Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:36: + 1373 | *t331*t333*t253) + | ^ +Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't288' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't283' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & - | ^ -note: 't372' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2212:29: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't280' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't277' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 2212 | *t1776 - | ^ -Warning: 't371' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:30: + 1373 | *t331*t333*t253) + | ^ +Warning: 't276' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & - | ^ -note: 't371' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1844:40: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't273' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1844 | t864 = 0.1e1_dp/t370/t130 - | ^ -Warning: 't370' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:24: + 1373 | *t331*t333*t253) + | ^ +Warning: 't272' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & - | ^ -note: 't370' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1601:54: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't270' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't267' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1601 | t473*t435)*t51 - | ^ -Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:18: + 1373 | *t331*t333*t253) + | ^ +Warning: 't266' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & - | ^ -note: 't37' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1851:31: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't263' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't260' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't257' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1851 | t875 = t367*t874 - | ^ -Warning: 't367' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:87: + 1373 | *t331*t333*t253) + | ^ +Warning: 't256' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: - 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & - | ^ -note: 't367' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2014:38: + 1396 | *t114*t321*t909 + | ^ +Warning: 't254' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 2014 | t1372 = t366*t212*t1371 + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't253' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: + + 1385 | *t902 - t113*t114*t906 | ^ -Warning: 't366' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:81: +Warning: 't251' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & - | ^ -note: 't366' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2165:60: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: - 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 - | ^ -Warning: 't365' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:75: + 1385 | *t902 - t113*t114*t906 + | ^ +Warning: 't248' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1350:94: - 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & - | ^ -note: 't365' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: + 1350 | *t114*t820*t640) - (t113*t114*t321*t681) + | ^ +Warning: 't247' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: - 2099 | + t842 - t1609 - | ^ -Warning: 't364' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:69: + 1385 | *t902 - t113*t114*t906 + | ^ +Warning: 't244' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: Warning: 't240' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: Warning: 't238' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1416:88: - 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & - | ^ -note: 't364' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: + 1416 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t235*t408 - t76*t1073*Clda)*sx0 + | ^ +Warning: 't235' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: - 2099 | + t842 - t1609 - | ^ -Warning: 't363' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:63: + 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) + | ^ +Warning: 't232' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: - 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & + 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 | ^ -note: 't363' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2009:32: +Warning: 't231' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: Warning: 't229' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: - 2009 | t1361 = t362*t202 - | ^ -Warning: 't362' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:57: + 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) + | ^ +Warning: 't228' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: - 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & - | ^ -note: 't362' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2075:32: + 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 + | ^ +Warning: 't227' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: - 2075 | t1582 = t359*t254 - | ^ -Warning: 't359' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:51: + 1305 | (48._dp*t224*t181) + | ^ +Warning: 't224' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: 't216' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: 't215' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: - 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & - | ^ -note: 't359' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2073:32: + 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) + | ^ +Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1301:25: - 2073 | t1578 = t357*t254 - | ^ -Warning: 't357' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:45: + 1301 | t543 = t212*t156 + | ^ +Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1398:31: - 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & - | ^ -note: 't357' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2142:75: + 1398 | t1062 = t851*t852*t211 + | ^ +Warning: 't211' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1300:72: - 2142 | t1626 - 0.1200e2_dp*t356*t340*t309 - 0.40e1_dp*t1668 - | ^ -Warning: 't356' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:39: + 1300 | - 0.16e2_dp/0.3e1_dp*t207*t139*t142 - (16._dp*t208*t146) + | ^ +Warning: 't208' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1300:72: Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1397:30: - 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & - | ^ -note: 't356' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2130:32: + 1397 | t1056 = 0.1e1_dp/t206 + | ^ +Warning: 't206' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1300:72: - 2130 | t1697 = t315*t355 - | ^ -Warning: 't355' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:33: + 1300 | - 0.16e2_dp/0.3e1_dp*t207*t139*t142 - (16._dp*t208*t146) + | ^ +Warning: 't203' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1300:72: Warning: 't202' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: - 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & - | ^ -note: 't355' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2010:32: + 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) + | ^ +Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: - 2010 | t1363 = t353*t254 - | ^ -Warning: 't353' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:27: + 1385 | *t902 - t113*t114*t906 + | ^ +Warning: 't197' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: - 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & - | ^ -note: 't353' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2202:58: + 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) + | ^ +Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: - 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 - | ^ -Warning: 't352' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:72: + 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 + | ^ +Warning: 't191' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1377:25: - 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 - | ^ -note: 't352' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1939:32: + 1377 | t874 = t342*t190 + | ^ +Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: - 1939 | t1137 = t351*t305 - | ^ -Warning: 't351' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:66: + 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 + | ^ +Warning: 't189' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: - 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 - | ^ -note: 't351' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1930:32: + 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) + | ^ +Warning: 't188' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: - 1930 | t1110 = t350*t142 - | ^ -Warning: 't350' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:60: + 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 + | ^ +Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: - 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 - | ^ -note: 't350' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2111:34: + 1396 | *t114*t321*t909 + | ^ +Warning: 't184' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: - 2111 | *t136*t1639 + 1305 | (48._dp*t224*t181) | ^ -Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:54: +Warning: 't181' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: 't175' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: - 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 - | ^ -note: 't347' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1928:28: + 1287 | t12*t61) + | ^ +Warning: 't173' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: - 1928 | t1096 - | ^ -Warning: 't344' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:48: + 1305 | (48._dp*t224*t181) + | ^ +Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: - 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 - | ^ -note: 't344' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2225:34: + 1287 | t12*t61) + | ^ +Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: - 2225 | *t136*t1986 + 1305 | (48._dp*t224*t181) | ^ -Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:42: +Warning: 't166' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1288:24: - 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 - | ^ -note: 't343' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2152:64: + 1288 | t508 = t165*t13 + | ^ +Warning: 't165' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: - 2152 | *t125*t340*t309 + t1775 - 0.40e1_dp*t1776 - | ^ -Warning: 't340' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:36: + 1287 | t12*t61) + | ^ +Warning: 't159' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: - 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 - | ^ -note: 't340' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2207:29: + 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 + | ^ +Warning: 't158' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: - 2207 | *t1094 - | ^ -Warning: 't338' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:25: + 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 + | ^ +Warning: 't157' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1301:25: - 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 + 1301 | t543 = t212*t156 | ^ -note: 't338' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2188:64: +Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1324:24: - 2188 | *t133*t90*t91*t789 + 0.80e1_dp*t1671*t327 - | ^ -Warning: 't337' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:19: + 1324 | t656 = t31*t154 + | ^ +Warning: 't154' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1278:33: - 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 - | ^ -note: 't337' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2142:75: + 1278 | t454 = 0.1e1_dp/t153/t65 + | ^ +Warning: 't153' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: - 2142 | t1626 - 0.1200e2_dp*t356*t340*t309 - 0.40e1_dp*t1668 - | ^ -Warning: 't333' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:13: + 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 + | ^ +Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: - 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 - | ^ -note: 't333' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2225:34: + 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) + | ^ +Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 2225 | *t136*t1986 - | ^ -Warning: 't332' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:96: + 1373 | *t331*t333*t253) + | ^ +Warning: 't149' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't332' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't146' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't142' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1271:25: - 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc - | ^ -Warning: 't329' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:90: + 1271 | t430 = t141*t135 + | ^ +Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't329' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1835:88: + 1276 | /0.3e1_dp*t140*t434 + (20._dp*t22*t438) + | ^ +Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc - | ^ -Warning: 't328' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:84: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't139' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't328' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1821:31: + 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 + | ^ +Warning: 't131' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1290:24: - 1821 | t825 = t732*t327 - | ^ -Warning: 't327' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:78: + 1290 | t515 = t42*t130 + | ^ +Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1269:34: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't327' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1835:88: + 1269 | t425 = t54*r3*t56*t6*t129 + | ^ +Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc - | ^ -Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:72: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't326' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: + 1276 | /0.3e1_dp*t140*t434 + (20._dp*t22*t438) + | ^ +Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc - | ^ -Warning: 't325' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:66: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't124' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't325' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1835:88: + 1373 | *t331*t333*t253) + | ^ +Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: - 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc - | ^ -Warning: 't324' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:60: + 1438 | + t403*t1066 + t403*t1069) + | ^ +Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't324' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1835:88: + 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 + | ^ +Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1197:22: - 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc - | ^ -Warning: 't323' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:54: + 1197 | t299 = t93**2 + | ^ +Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't323' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2101:32: + 1373 | *t331*t333*t253) + | ^ +Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1270:27: - 2101 | t1613 = t322*t591 - | ^ -Warning: 't322' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:48: + 1270 | t428 = t21/t9/t425 + | ^ +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1238:47: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't322' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1835:88: + 1238 | t364 = f12*(2._dp*t343*t89 + t79*t361) + | ^ +Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc - | ^ -Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:42: + 1373 | *t331*t333*t253) + | ^ +Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't321' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2145:32: + 1438 | + t403*t1066 + t403*t1069) + | ^ +Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: - 2145 | t1765 = t320*t479 + 1396 | *t114*t321*t909 | ^ -Warning: 't320' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:36: +Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1399:35: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't320' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2148:32: + 1399 | t1066 = t331*t332*t227*t83 + | ^ +Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1234:53: - 2148 | t1776 = t317*t591 + 1234 | t352 = 2._dp*t343*t81 + t79*t347 - t113*t350 + | ^ +Warning: 't81' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: + + 1396 | *t114*t321*t909 | ^ -Warning: 't317' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:25: +Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't317' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2129:32: + 1373 | *t331*t333*t253) + | ^ +Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1339:23: - 2129 | t1696 = t316*t704 - | ^ -Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:19: + 1339 | t811 = t78*t16 + | ^ +Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1439:62: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't316' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2130:32: + 1439 | e_ndrho_ndrho = e_ndrho_ndrho + (-t76*t1205*Clda)*sx0 + | ^ +Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1320:22: - 2130 | t1697 = t315*t355 - | ^ -Warning: 't315' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:13: + 1320 | t633 = t74**2 + | ^ +Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: - 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & - | ^ -note: 't315' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2225:34: + 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 + | ^ +Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: - 2225 | *t136*t1986 - | ^ -Warning: 't312' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:94: + 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) + | ^ +Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't312' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1751:31: + 1373 | *t331*t333*t253) + | ^ +Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1418:24: - 1751 | t730 = t352*t309 - | ^ -Warning: 't309' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:88: + 1418 | t1080 = t69*t13 + | ^ +Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't309' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1739:35: + 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 + | ^ +Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: - 1739 | t715 = 0.2e1_dp*t306 - | ^ -Warning: 't306' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:82: + 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 + | ^ +Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1162:25: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't306' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2147:41: + 1162 | t231 = t66*ndrho + | ^ +Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 2147 | t1775 = 0.2e1_dp*t729*t305 - | ^ -Warning: 't305' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:76: + 1373 | *t331*t333*t253) + | ^ +Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1316:30: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't305' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2123:54: + 1316 | a5*t18*t52*t63 + | ^ +Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: - 2123 | t1690 = 0.2400e2_dp*t771*t304*t133*t309 - | ^ -Warning: 't304' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:70: + 1287 | t12*t61) + | ^ +Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1131:31: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't304' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1491:32: + 1131 | t181 = t58/t59/rho*t61 + | ^ +Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: - 1491 | t309 = -t3 - t132 - | ^ -Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:64: + 1287 | t12*t61) + | ^ +Warning: 't53' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't3' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: + 1276 | /0.3e1_dp*t140*t434 + (20._dp*t22*t438) + | ^ +Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1316:30: - 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 - | ^ -Warning: 't298' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:60: + 1316 | a5*t18*t52*t63 + | ^ +Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't298' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1724:31: + 1287 | t12*t61) + | ^ +Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1272:26: - 1724 | t691 = t297*t393 - | ^ -Warning: 't297' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:54: + 1272 | t434 = t44*t28*t7 + | ^ +Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1290:24: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't297' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: + 1290 | t515 = t42*t130 + | ^ +Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: - 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 - | ^ -Warning: 't295' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:48: + 1287 | t12*t61) + | ^ +Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1158:26: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't295' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1718:31: + 1158 | t224 = a5*t36*t52 + | ^ +Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: - 1718 | t679 = t678*t294 - | ^ -Warning: 't294' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:42: + 1287 | t12*t61) + | ^ +Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1281:32: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't294' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1720:31: + 1281 | t465 = t32*t154*t78*t42 + | ^ +Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: - 1720 | t682 = t293*t681 - | ^ -Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:36: + 1396 | *t114*t321*t909 + | ^ +Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't293' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1717:43: + 1438 | + t403*t1066 + t403*t1069) + | ^ +Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1273:28: - 1717 | t674*t619 - t291*t627 - | ^ -Warning: 't291' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:30: + 1273 | t438 = t24*t173*t28 + | ^ +Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1292:23: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't291' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1571:39: + 1292 | t520 = t26*t15 + | ^ +Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: - 1571 | t429 = 0.1e1_dp/t427/t29 - | ^ -Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:24: + 1287 | t12*t61) + | ^ +Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1273:28: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't29' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1971:47: + 1273 | t438 = t24*t173*t28 + | ^ +Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: - 1971 | *t674*t1171 - t291*t1181 - | ^ -Warning: 't288' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:19: + 1276 | /0.3e1_dp*t140*t434 + (20._dp*t22*t438) + | ^ +Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1316:30: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't288' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1971:47: + 1316 | a5*t18*t52*t63 + | ^ +Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: - 1971 | *t674*t1171 - t291*t1181 - | ^ -Warning: 't287' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:13: + 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) + | ^ +Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: - 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & - | ^ -note: 't287' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1704:31: + 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) + | ^ +Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: - 1704 | t651 = t379*t283 - | ^ -Warning: 't283' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:89: + 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 + | ^ +Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1418:24: - 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & - | ^ -note: 't283' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1964:43: + 1418 | t1080 = t69*t13 + | ^ +Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1375:54: - 1964 | t1252 = t865/t659/t282*t1250 - | ^ -Warning: 't282' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:83: + 1375 | - t76*t865*Clda)*sx0 + | ^ +Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & - | ^ -note: 't282' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1963:30: + 1373 | *t331*t333*t253) + | ^ +Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: - 1963 | t1250 = t280**2 + 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 + | ^ +Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1332:30: + + 1332 | t113*t114*t678 | ^ -Warning: 't280' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:77: +Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: - 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & - | ^ -note: 't280' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 1385 | *t902 - t113*t114*t906 + | ^ +Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1229:24: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't279' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:66: + 1229 | t343 = t342*t11 + | ^ +Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: - 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & - | ^ -note: 't279' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1703:31: + 1438 | + t403*t1066 + t403*t1069) + | ^ +Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1703 | t648 = t278*t393 - | ^ -Warning: 't278' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:60: + 1373 | *t331*t333*t253) + | ^ +Warning: 't107' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: - 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & - | ^ -note: 't278' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1957:41: + 1438 | + t403*t1066 + t403*t1069) + | ^ +Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: - 1957 | t1218 = 0.1e1_dp/t654/t276 - | ^ -Warning: 't276' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:48: + 1373 | *t331*t333*t253) + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't100' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1217:22: - 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & - | ^ -note: 't276' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 1217 | t328 = t3*t10 + | ^ +Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1148:24: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't273' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:42: + 1148 | t206 = t1*ndrho + | ^ +Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5635:90: - 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & - | ^ -note: 't273' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1696:31: + 5635 | 1.0_dp/Q*(dQrho*dQndrho + d2Qrhondrho) + 1.0_dp/(Q*Q)*dQrho*dQndrho + | ^ +Warning: 'dqrho' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:362:76: - 1696 | t634 = t272*t406 - | ^ -Warning: 't272' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:36: + 362 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & + | ^ +note: 'dqrho' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: - 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & - | ^ -note: 't272' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1733:62: + 885 | *t71*t678)/0.2e1_dp) + | ^ +Warning: 'dqndrho' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:912:88: - 1733 | *t697*t662)*t122) - | ^ -Warning: 't269' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:25: + 912 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t269*t520 - t76*t1369*Clda)*sx0 + | ^ +Warning: 't520' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & - | ^ -note: 't269' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1953:63: + 948 | *t1365)) + | ^ +Warning: 't515' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't514' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: - 1953 | *t622*t874 - 0.9531842928e0_dp*t266*t887 - | ^ -Warning: 't266' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:19: + 929 | *t148*t983*t1372 - t147*t148*t404*t1395 + | ^ +Warning: 't511' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: Warning: 't510' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: Warning: 't508' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: Warning: 't507' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:919:32: - 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & - | ^ -note: 't266' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 919 | t147*t148*t1392 + | ^ +Warning: 't504' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:919:32: Warning: 't501' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't265' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:13: + 948 | *t1365)) + | ^ +Warning: 't497' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't495' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't491' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:886:26: - 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & - | ^ -note: 't265' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1943:38: + 886 | t1263 = t489*t136 + | ^ +Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 1943 | t1149 = t366*t264*t1148 - | ^ -Warning: 't264' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:97: + 948 | *t1365)) + | ^ +Warning: 't485' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't484' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't480' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't264' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1948:30: + 885 | *t71*t678)/0.2e1_dp) + | ^ +Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 1948 | t1165 = t263**2 - | ^ -Warning: 't263' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:91: + 948 | *t1365)) + | ^ +Warning: 't476' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:870:45: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't263' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + 870 | + t888*t148*t889*t261) + | ^ +Warning: 't475' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: - 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 - | ^ -Warning: 't260' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:85: + 885 | *t71*t678)/0.2e1_dp) + | ^ +Warning: 't472' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't260' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: + 948 | *t1365)) + | ^ +Warning: 't465' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't463' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't449' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't447' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't446' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:921:112: - 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc - | ^ -Warning: 't259' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:79: + 921 | t66 - 2._dp*t440*t432 + 2._dp*t86*t1388 - t86*t1392) + | ^ +Warning: 't444' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't259' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1742:88: + 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) + | ^ +Warning: 't443' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: Warning: 't440' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 1742 | + t712 + 0.2e1_dp*t256 + 0.80e1_dp*t258 + t715)*sc - | ^ -Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:73: + 948 | *t1365)) + | ^ +Warning: 't435' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:919:32: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't258' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1669:31: + 919 | t147*t148*t1392 + | ^ +Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:921:112: - 1669 | t594 = t352*t257 - | ^ -Warning: 't257' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:67: + 921 | t66 - 2._dp*t440*t432 + 2._dp*t86*t1388 - t86*t1392) + | ^ +Warning: 't432' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:919:32: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't257' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: + 919 | t147*t148*t1392 + | ^ +Warning: 't430' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: - 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc - | ^ -Warning: 't256' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:61: + 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 + | ^ +Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't256' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1738:35: + 862 | - t147*t148*t1114 + | ^ +Warning: 't426' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:853:26: - 1738 | t712 = 0.2e1_dp*t255 - | ^ -Warning: 't255' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:55: + 853 | t1082 = t425*t224 + | ^ +Warning: 't425' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:851:55: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + 851 | - t76*t1073*Clda)*sx0 | ^ -note: 't255' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1613:31: - - 1613 | t491 = t144*t254 - | ^ -Warning: 't254' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:49: +Warning: 't423' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't254' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2146:49: + 948 | *t1365)) + | ^ +Warning: 't418' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 2146 | t1768 = 0.2400e2_dp*t750*t253*t751 - | ^ -Warning: 't253' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:43: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't416' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:900:35: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't253' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2138:52: + 900 | t1362 = t414*t415*t261*t83 + | ^ +Warning: 't415' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 2138 | t1730 = 0.160e2_dp*t755*t756*t252*t91 - | ^ -Warning: 't252' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:37: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't414' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't413' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't252' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: + 911 | + t412*t1362 + t412*t1365)) + | ^ +Warning: 't412' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't246' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:31: + 948 | *t1365)) + | ^ +Warning: 't411' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't246' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1657:31: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't410' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 1657 | t577 = t245*t393 - | ^ -Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:25: + 948 | *t1365)) + | ^ +Warning: 't409' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't245' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: + 911 | + t412*t1362 + t412*t1365)) + | ^ +Warning: 't408' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: - 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 - | ^ -Warning: 't243' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:19: + 897 | *t148*t404*t1117 + | ^ +Warning: 't406' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:818:51: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't243' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1651:31: + 818 | *(t628)*(t391) + (4._dp*t394*t406) + | ^ +Warning: 't404' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: - 1651 | t565 = t564*t242 - | ^ -Warning: 't242' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:13: + 897 | *t148*t404*t1117 + | ^ +Warning: 't402' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:818:51: - 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & - | ^ -note: 't242' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1653:31: + 818 | *(t628)*(t391) + (4._dp*t394*t406) + | ^ +Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: - 1653 | t568 = t241*t567 - | ^ -Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:95: + 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 + | ^ +Warning: 't398' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:776:26: - 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & - | ^ -note: 't241' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1388:30: + 776 | *t148*t788 + | ^ +Warning: 't397' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: - 1388 | t150 = t149*t24 - | ^ -Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:89: + 862 | - t147*t148*t1114 + | ^ +Warning: 't394' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: - 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & - | ^ -note: 't24' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1650:43: + 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 + | ^ +Warning: 't391' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: Warning: 't390' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: - 1650 | t560*t505 - t239*t513 - | ^ -Warning: 't239' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:84: + 862 | - t147*t148*t1114 + | ^ +Warning: 't388' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: - 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & - | ^ -note: 't239' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2031:47: + 911 | + t412*t1362 + t412*t1365)) + | ^ +Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 2031 | *t560*t1394 - t239*t1404 - | ^ -Warning: 't236' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:78: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: - 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & - | ^ -note: 't236' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1637:31: + 911 | + t412*t1362 + t412*t1365)) + | ^ +Warning: 't381' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: Warning: 't377' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: Warning: 't374' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:799:25: - 1637 | t537 = t379*t231 - | ^ -Warning: 't231' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:60: + 799 | t952 = t372*t136 + | ^ +Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: - 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & - | ^ -note: 't231' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2043:43: + 885 | *t71*t678)/0.2e1_dp) + | ^ +Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: 't367' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: 't363' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 2043 | t1524 = t865/t545/t230*t1522 - | ^ -Warning: 't230' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:54: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't362' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: - 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & - | ^ -note: 't230' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1420:70: + 885 | *t71*t678)/0.2e1_dp) + | ^ +Warning: 't361' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: 't359' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: - 1420 | t37*(t193*t23 + 0.3177280975e0_dp*t196*t180)*t51 - | ^ -Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:48: + 897 | *t148*t404*t1117 + | ^ +Warning: 't358' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & - | ^ -note: 't23' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2042:30: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't357' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't356' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't355' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't345' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't344' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:793:30: - 2042 | t1522 = t228**2 + 793 | t910 = t119*t343*t123 | ^ -Warning: 't228' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:43: - - 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & - | ^ -note: 't228' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: +Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't227' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:37: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:870:45: - 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & - | ^ -note: 't227' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1636:31: + 870 | + t888*t148*t889*t261) + | ^ +Warning: 't340' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1636 | t534 = t226*t393 - | ^ -Warning: 't226' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:31: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't338' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't336' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: - 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & - | ^ -note: 't226' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2036:41: + 885 | *t71*t678)/0.2e1_dp) + | ^ +Warning: 't327' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 2036 | t1490 = 0.1e1_dp/t540/t224 - | ^ -Warning: 't224' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:19: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:782:24: - 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & - | ^ -note: 't224' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 782 | t854 = t323*t83 + | ^ +Warning: 't323' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:13: + 885 | *t71*t678)/0.2e1_dp) + | ^ +Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: 't314' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: - 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & - | ^ -note: 't221' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1629:31: + 911 | + t412*t1362 + t412*t1365)) + | ^ +Warning: 't307' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1629 | t520 = t220*t406 - | ^ -Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:94: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't306' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: - 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & - | ^ -note: 't220' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1666:64: + 911 | + t412*t1362 + t412*t1365)) + | ^ +Warning: 't304' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: - 1666 | *t583*t548)*t86)*t91 - | ^ -Warning: 't217' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:88: + 885 | *t71*t678)/0.2e1_dp) + | ^ +Warning: 't303' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: - 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & - | ^ -note: 't217' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2024:63: + 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) + | ^ +Warning: 't301' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:780:132: - 2024 | *t508*t874 - 0.9531842928e0_dp*t214*t887 - | ^ -Warning: 't214' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:82: + 780 | *t553*t66 - 2._dp*t297*t284 + 2._dp*t86*t784 - t86*t788)) + | ^ +Warning: 't300' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: - 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & - | ^ -note: 't214' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) + | ^ +Warning: 't297' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: Warning: 't294' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: Warning: 't291' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:780:132: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:76: + 780 | *t553*t66 - 2._dp*t297*t284 + 2._dp*t86*t784 - t86*t788)) + | ^ +Warning: 't290' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: - 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & - | ^ -note: 't213' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2014:38: + 897 | *t148*t404*t1117 + | ^ +Warning: 't288' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: - 2014 | t1372 = t366*t212*t1371 - | ^ -Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:70: + 911 | + t412*t1362 + t412*t1365)) + | ^ +Warning: 't287' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: - 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & - | ^ -note: 't212' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2019:30: + 862 | - t147*t148*t1114 + | ^ +Warning: 't285' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: - 2019 | t1388 = t211**2 - | ^ -Warning: 't211' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:64: + 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) + | ^ +Warning: 't284' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: - 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & - | ^ -note: 't211' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + 862 | - t147*t148*t1114 + | ^ +Warning: 't282' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:818:51: - 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 - | ^ -Warning: 't208' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:58: + 818 | *(t628)*(t391) + (4._dp*t394*t406) + | ^ +Warning: 't281' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: - 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & - | ^ -note: 't208' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: + 862 | - t147*t148*t1114 + | ^ +Warning: 't278' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: Warning: 't275' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: Warning: 't274' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: Warning: 't272' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:912:88: - 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc - | ^ -Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:52: + 912 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t269*t520 - t76*t1369*Clda)*sx0 + | ^ +Warning: 't269' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: - 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & - | ^ -note: 't207' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1742:88: + 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) + | ^ +Warning: 't266' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: - 1742 | + t712 + 0.2e1_dp*t256 + 0.80e1_dp*t258 + t715)*sc - | ^ -Warning: 't206' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:46: + 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 + | ^ +Warning: 't265' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: Warning: 't263' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: - 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & - | ^ -note: 't206' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: + 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) + | ^ +Warning: 't262' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:870:45: - 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc - | ^ -Warning: 't205' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:40: + 870 | + t888*t148*t889*t261) + | ^ +Warning: 't261' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: - 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & - | ^ -note: 't205' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2074:32: + 749 | (48._dp*t258*t215) + | ^ +Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: 't254' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: 't253' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: 't249' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: - 2074 | t1580 = t204*t591 - | ^ -Warning: 't204' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:27: + 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) + | ^ +Warning: 't247' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:744:25: - 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & - | ^ -note: 't204' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1737:35: + 744 | t655 = t246*t190 + | ^ +Warning: 't246' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:899:33: - 1737 | t709 = 0.2e1_dp*t203 - | ^ -Warning: 't203' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1241:77: + 899 | t1358 = t1059*t1060*t245 + | ^ +Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: - 1241 | t1998, t1999, t2, t20, t2010, t2011, t2014, t2019, t202, t2025, t203 - | ^ -note: 't203' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2144:41: + 743 | - 0.16e2_dp/0.3e1_dp*t241*t173*t176 - (16._dp*t242*t180) + | ^ +Warning: 't242' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:898:30: - 2144 | t1764 = 0.2e1_dp*t741*t202 - | ^ -Warning: 't202' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1241:64: + 898 | t1352 = 0.1e1_dp/t240 + | ^ +Warning: 't240' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: - 1241 | t1998, t1999, t2, t20, t2010, t2011, t2014, t2019, t202, t2025, t203 - | ^ -note: 't202' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1508:56: + 743 | - 0.16e2_dp/0.3e1_dp*t241*t173*t176 - (16._dp*t242*t180) + | ^ +Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: Warning: 't236' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: - 1508 | t55 + t93 + t127)*sc - | ^ -Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1241:25: + 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) + | ^ +Warning: 't233' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: - 1241 | t1998, t1999, t2, t20, t2010, t2011, t2014, t2019, t202, t2025, t203 - | ^ -note: 't2' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: + 862 | - t147*t148*t1114 + | ^ +Warning: 't231' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: - 1900 | *t45*t1020*t984*t1027 - | ^ -Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1240:72: + 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) + | ^ +Warning: 't228' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: - 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & + 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 | ^ -note: 't196' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1592:31: - - 1592 | t467 = t195*t393 - | ^ -Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1240:66: +Warning: 't225' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:853:26: - 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & - | ^ -note: 't195' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: + 853 | t1082 = t425*t224 + | ^ +Warning: 't224' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: - 1900 | *t45*t1020*t984*t1027 - | ^ -Warning: 't193' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1240:39: + 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 + | ^ +Warning: 't223' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: - 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & - | ^ -note: 't193' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1586:31: + 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) + | ^ +Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: - 1586 | t455 = t454*t192 - | ^ -Warning: 't192' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1240:33: + 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 + | ^ +Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: - 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & + 897 | *t148*t404*t1117 | ^ -note: 't192' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1588:31: +Warning: 't218' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: - 1588 | t458 = t191*t457 - | ^ -Warning: 't191' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1240:27: + 749 | (48._dp*t258*t215) + | ^ +Warning: 't215' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: 't209' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: - 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & - | ^ -note: 't191' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1585:43: + 730 | t12*t61) + | ^ +Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: - 1585 | t450*t385 - t189*t399 - | ^ -Warning: 't189' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1239:61: + 749 | (48._dp*t258*t215) + | ^ +Warning: 't203' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: - 1239 | t1858, t186, t1868, t1870, t1872, t1884, t1886, t189, t1891, t1893, t1894, t1897, t19, & - | ^ -note: 't189' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1733:62: + 730 | t12*t61) + | ^ +Warning: 't202' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: Warning: 't201' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: - 1733 | *t697*t662)*t122) - | ^ -Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1239:20: + 749 | (48._dp*t258*t215) + | ^ +Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:731:24: - 1239 | t1858, t186, t1868, t1870, t1872, t1884, t1886, t189, t1891, t1893, t1894, t1897, t19, & - | ^ -note: 't186' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1581:31: + 731 | t620 = t199*t13 + | ^ +Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: - 1581 | t447 = t185*t337 - | ^ -Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1238:80: + 730 | t12*t61) + | ^ +Warning: 't193' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: - 1238 | t180, t1804, t1826, t1829, t183, t1832, t1836, t1838, t1839, t184, t185, t1850, t1853, & - | ^ -note: 't185' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1876:39: + 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 + | ^ +Warning: 't192' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: - 1876 | *t896 - t189*t914 - | ^ -Warning: 't184' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1238:74: + 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 + | ^ +Warning: 't191' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:744:25: - 1238 | t180, t1804, t1826, t1829, t183, t1832, t1836, t1838, t1839, t184, t185, t1850, t1853, & - | ^ -note: 't184' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1392:30: + 744 | t655 = t246*t190 + | ^ +Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:871:26: - 1392 | t156 = t18*t155 - | ^ -Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1237:94: + 871 | t1242 = t245*t188 + | ^ +Warning: 't188' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:721:33: - 1237 | t1775, t1776, t1778, t178, t1782, t1783, t1785, t1786, t1789, t179, t1795, t1797, t18, & - | ^ -note: 't18' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1569:31: + 721 | t566 = 0.1e1_dp/t187/t65 + | ^ +Warning: 't187' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: - 1569 | t424 = t379*t179 - | ^ -Warning: 't179' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1237:75: + 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 + | ^ +Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: - 1237 | t1775, t1776, t1778, t178, t1782, t1783, t1785, t1786, t1789, t179, t1795, t1797, t18, & - | ^ -note: 't179' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1889:43: + 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) + | ^ +Warning: 't184' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1889 | t1027 = t865/t432/t178*t1025 - | ^ -Warning: 't178' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1237:34: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't183' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: - 1237 | t1775, t1776, t1778, t178, t1782, t1783, t1785, t1786, t1789, t179, t1795, t1797, t18, & + 749 | (48._dp*t258*t215) | ^ -note: 't178' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1888:30: - - 1888 | t1025 = t176**2 - | ^ -Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1236:72: - - 1236 | t1701, t172, t1726, t173, t1730, t174, t175, t1750, t1754, t176, t1764, t1765, t1768, & - | ^ -note: 't176' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: +Warning: 't180' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:713:25: - 1917 | *bp*t1020*t984*t1027 - | ^ + 713 | t542 = t175*t169 + | ^ Warning: 't175' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1236:52: - - 1236 | t1701, t172, t1726, t173, t1730, t174, t175, t1750, t1754, t176, t1764, t1765, t1768, & - | ^ -note: 't175' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1568:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: - 1568 | t421 = t174*t393 - | ^ + 719 | *t550) + | ^ Warning: 't174' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1236:46: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: - 1236 | t1701, t172, t1726, t173, t1730, t174, t175, t1750, t1754, t176, t1764, t1765, t1768, & - | ^ -note: 't174' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1882:40: + 749 | (48._dp*t258*t215) + | ^ +Warning: 't173' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1882 | t993 = 0.1e1_dp/t427/t172 - | ^ + 849 | + (t412)*t414*t416*(t287)) + | ^ Warning: 't172' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1236:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: - 1236 | t1701, t172, t1726, t173, t1730, t174, t175, t1750, t1754, t176, t1764, t1765, t1768, & - | ^ -note: 't172' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1901:48: + 743 | - 0.16e2_dp/0.3e1_dp*t241*t173*t176 - (16._dp*t242*t180) + | ^ +Warning: 't166' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: - 1901 | t1043 = t17**(-0.2333333333e1_dp) - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1235:94: + 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 + | ^ +Warning: 't165' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1235 | REAL(KIND=dp) :: t1671, t1672, t1675, t168, t169, t1690, t1694, t1696, t1697, t1698, t17, & - | ^ -note: 't17' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't164' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:711:34: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1235:54: + 711 | t537 = t54*r3*t56*t6*t163 + | ^ +Warning: 't163' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: - 1235 | REAL(KIND=dp) :: t1671, t1672, t1675, t168, t169, t1690, t1694, t1696, t1697, t1698, t17, & - | ^ -note: 't169' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1559:31: + 743 | - 0.16e2_dp/0.3e1_dp*t241*t173*t176 - (16._dp*t242*t180) + | ^ +Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: - 1559 | t403 = t402*t168 - | ^ -Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1235:48: + 719 | *t550) + | ^ +Warning: 't159' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1235 | REAL(KIND=dp) :: t1671, t1672, t1675, t168, t169, t1690, t1694, t1696, t1697, t1698, t17, & - | ^ -note: 't168' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1561:31: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't158' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 1561 | t407 = t167*t406 - | ^ -Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1234:75: + 948 | *t1365)) + | ^ +Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: - 1234 | t1639, t164, t1653, t1654, t1657, t1659, t1664, t1666, t1668, t167 - | ^ -note: 't167' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1601:54: + 929 | *t148*t983*t1372 - t147*t148*t404*t1395 + | ^ +Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1601 | t473*t435)*t51 - | ^ -Warning: 't164' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1234:20: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:712:27: - 1234 | t1639, t164, t1653, t1654, t1657, t1659, t1664, t1666, t1668, t167 - | ^ -note: 't164' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1865:62: + 712 | t540 = t21/t9/t537 + | ^ +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:674:41: - 1865 | *t394*t874 - 0.9531842928e0_dp*t161*t887 - | ^ -Warning: 't161' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1233:48: + 674 | t446 = 2._dp*t426*t89 + t79*t444 + | ^ +Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:780:132: - 1233 | t1603, t1604, t1605, t1606, t1609, t161, t1610, t1611, t1613, t1615, t1620, t1622, t1626, & - | ^ -note: 't161' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1578:31: + 780 | *t553*t66 - 2._dp*t297*t284 + 2._dp*t86*t784 - t86*t788)) + | ^ +Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:921:112: - 1578 | t440 = t439*t160 - | ^ -Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1232:87: + 921 | t66 - 2._dp*t440*t432 + 2._dp*t86*t1388 - t86*t1392) + | ^ +Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: - 1232 | t1570, t1576, t1578, t1580, t1582, t1588, t159, t1590, t1593, t1599, t16, t160, t1602, & - | ^ -note: 't160' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1862:49: + 897 | *t148*t404*t1117 + | ^ +Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 1862 | t905 = 0.1817120592e1_dp*t157*t371 - | ^ -Warning: 't157' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1231:93: + 948 | *t1365)) + | ^ +Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:670:53: - 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & - | ^ -note: 't157' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 670 | t435 = 2._dp*t426*t81 + t79*t430 - t147*t433 + | ^ +Warning: 't81' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1231:80: + 897 | *t148*t404*t1117 + | ^ +Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:776:26: - 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & - | ^ -note: 't156' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1848:36: + 776 | *t148*t788 + | ^ +Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:807:24: - 1848 | t870 = t366*t155*t869 - | ^ -Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1231:74: + 807 | t1023 = t78*t16 + | ^ +Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:949:62: - 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & - | ^ -note: 't155' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1856:29: + 949 | e_ndrho_ndrho = e_ndrho_ndrho + (-t76*t1561*Clda)*sx0 + | ^ +Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:764:22: - 1856 | t890 = t154**2 - | ^ -Warning: 't154' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1231:68: + 764 | t744 = t74**2 + | ^ +Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: - 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & - | ^ -note: 't154' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2018:32: + 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 + | ^ +Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: - 2018 | t1383 = t151*t513 - | ^ -Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1231:20: + 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) + | ^ +Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:776:26: - 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & - | ^ -note: 't151' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 776 | *t148*t788 + | ^ +Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:870:45: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1230:91: + 870 | + t888*t148*t889*t261) + | ^ +Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: - 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & - | ^ -note: 't150' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1421:30: + 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 + | ^ +Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: - 1421 | t203 = t15*t202 + 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 + | ^ +Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:572:25: + + 572 | t265 = t66*ndrho + | ^ +Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:658:24: + + 658 | t416 = t415*t65 + | ^ +Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:760:30: + + 760 | a5*t18*t52*t63 | ^ -Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1230:85: +Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: - 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & - | ^ -note: 't15' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + 730 | t12*t61) + | ^ +Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:541:31: - 1917 | *bp*t1020*t984*t1027 - | ^ -Warning: 't149' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1230:66: + 541 | t215 = t58/t59/rho*t61 + | ^ +Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: - 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & - | ^ -note: 't149' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: + 730 | t12*t61) + | ^ +Warning: 't53' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: - 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc - | ^ -Warning: 't148' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1230:46: + 719 | *t550) + | ^ +Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:760:30: - 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & - | ^ -note: 't148' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1919:32: + 760 | a5*t18*t52*t63 + | ^ +Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: - 1919 | t1086 = t147*t479 - | ^ -Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1230:33: + 730 | t12*t61) + | ^ +Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:714:26: - 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & - | ^ -note: 't147' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1613:31: + 714 | t546 = t44*t28*t7 + | ^ +Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:733:24: - 1613 | t491 = t144*t254 - | ^ -Warning: 't144' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1230:13: + 733 | t627 = t42*t164 + | ^ +Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: - 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & - | ^ -note: 't144' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1528:31: + 730 | t12*t61) + | ^ +Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:568:26: - 1528 | t359 = t143*t340 - | ^ -Warning: 't143' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1229:94: + 568 | t258 = a5*t36*t52 + | ^ +Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: - 1229 | t1374, t1377, t1380, t1383, t1388, t1389, t1391, t1394, t140, t1404, t141, t142, t143, & - | ^ -note: 't143' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2183:32: + 730 | t12*t61) + | ^ +Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:724:32: - 2183 | t1858 = t802*t142 + 724 | t577 = t32*t188*t78*t42 | ^ -Warning: 't142' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1229:88: +Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:821:23: - 1229 | t1374, t1377, t1380, t1383, t1388, t1389, t1391, t1394, t140, t1404, t141, t142, t143, & - | ^ -note: 't142' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2077:32: + 821 | t1057 = t31**2 + | ^ +Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:760:30: - 2077 | t1590 = t141*t704 - | ^ -Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1229:82: + 760 | a5*t18*t52*t63 + | ^ +Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:715:28: - 1229 | t1374, t1377, t1380, t1383, t1388, t1389, t1391, t1394, t140, t1404, t141, t142, t143, & - | ^ -note: 't141' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1932:32: + 715 | t550 = t24*t207*t28 + | ^ +Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:735:23: - 1932 | t1113 = t140*t355 - | ^ -Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1229:69: + 735 | t632 = t26*t15 + | ^ +Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: - 1229 | t1374, t1377, t1380, t1383, t1388, t1389, t1391, t1394, t140, t1404, t141, t142, t143, & - | ^ -note: 't140' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1746:31: + 730 | t12*t61) + | ^ +Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:715:28: - 1746 | t722 = t343*t137 - | ^ -Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1228:82: + 715 | t550 = t24*t207*t28 + | ^ +Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: - 1228 | REAL(KIND=dp) :: t1346, t1358, t136, t1360, t1361, t1363, t1365, t1368, t137, t1371, t1372, & - | ^ -note: 't137' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2173:33: + 719 | *t550) + | ^ +Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:760:30: - 2173 | *t725*t371 - | ^ -Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1228:41: + 760 | a5*t18*t52*t63 + | ^ +Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: - 1228 | REAL(KIND=dp) :: t1346, t1358, t136, t1360, t1361, t1363, t1365, t1368, t137, t1371, t1372, & - | ^ -note: 't136' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1780:31: + 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) + | ^ +Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:851:55: - 1780 | t772 = t125*t133 - | ^ -Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1227:56: + 851 | - t76*t1073*Clda)*sx0 + | ^ +Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: - 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 + 929 | *t148*t983*t1372 - t147*t148*t404*t1395 | ^ -note: 't133' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1698:31: +Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: - 1698 | t636 = t635*t131 - | ^ -Warning: 't131' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1227:44: + 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) + | ^ +Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: - 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 - | ^ -note: 't131' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1844:40: + 929 | *t148*t983*t1372 - t147*t148*t404*t1395 + | ^ +Warning: 't149' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:776:26: - 1844 | t864 = 0.1e1_dp/t370/t130 - | ^ -Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1227:38: + 776 | *t148*t788 + | ^ +Warning: 't148' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: - 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 - | ^ -note: 't130' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1486:30: + 862 | - t147*t148*t1114 + | ^ +Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: - 1486 | t306 = t13*t305 - | ^ -Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1227:32: + 911 | + t412*t1362 + t412*t1365)) + | ^ +Warning: 't143' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 - | ^ -note: 't13' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2173:33: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't142' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: - 2173 | *t725*t371 - | ^ -Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1227:20: + 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 + | ^ +Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 - | ^ -note: 't129' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1508:56: + 948 | *t1365)) + | ^ +Warning: 't139' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:630:25: - 1508 | t55 + t93 + t127)*sc - | ^ -Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1226:94: + 630 | t374 = t135*t136 + | ^ +Warning: 't135' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 1226 | t1211, t1218, t122, t1221, t1235, t1238, t1244, t1245, t125, t1250, t1252, t126, t127, & - | ^ -note: 't127' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1456:31: + 948 | *t1365)) + | ^ +Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1456 | t257 = t126*t133 - | ^ -Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1226:88: + 849 | + (t412)*t414*t416*(t287)) + | ^ +Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: - 1226 | t1211, t1218, t122, t1221, t1235, t1238, t1244, t1245, t125, t1250, t1252, t126, t127, & - | ^ -note: 't126' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1780:31: + 885 | *t71*t678)/0.2e1_dp) + | ^ +Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1780 | t772 = t125*t133 - | ^ + 849 | + (t412)*t414*t416*(t287)) + | ^ Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1226:68: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: - 1226 | t1211, t1218, t122, t1221, t1235, t1238, t1244, t1245, t125, t1250, t1252, t126, t127, & - | ^ -note: 't125' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1733:62: + 885 | *t71*t678)/0.2e1_dp) + | ^ +Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1733 | *t697*t662)*t122) - | ^ + 849 | + (t412)*t414*t416*(t287)) + | ^ Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1226:27: - - 1226 | t1211, t1218, t122, t1221, t1235, t1238, t1244, t1245, t125, t1250, t1252, t126, t127, & - | ^ -note: 't122' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1381:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:819:25: - 1381 | t141 = t140*t12 - | ^ + 819 | t1055 = t411*t12 + | ^ Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1225:74: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:617:30: - 1225 | t1154, t1157, t116, t1160, t1165, t1166, t1168, t1171, t1181, t12, t120, t1205, t1208, & - | ^ -note: 't12' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1481:31: + 617 | t355 = t119*t120*t122 + | ^ +Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:787:24: - 1481 | t297 = t116*t277 - | ^ -Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1225:27: + 787 | t875 = t97*t118 + | ^ +Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: - 1225 | t1154, t1157, t116, t1160, t1165, t1166, t1168, t1171, t1181, t12, t120, t1205, t1208, & - | ^ -note: 't116' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1477:31: + 948 | *t1365)) + | ^ +Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:602:30: - 1477 | t291 = t111*t264 - | ^ + 602 | t326 = t110/t111/t323 + | ^ Warning: 't111' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1223:72: - - 1223 | t1089, t109, t1094, t1096, t1099, t11, t110, t1108, t1109, t111, t1110, t1111, t1113, & - | ^ -note: 't111' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1972:41: - - 1972 | t1299 = t110**(-0.40e1_dp) - | ^ -Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1223:52: - - 1223 | t1089, t109, t1094, t1096, t1099, t11, t110, t1108, t1109, t111, t1110, t1111, t1113, & - | ^ -note: 't110' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1526:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:665:24: - 1526 | t356 = t11*t355 - | ^ + 665 | t426 = t425*t11 + | ^ Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1223:46: - - 1223 | t1089, t109, t1094, t1096, t1099, t11, t110, t1108, t1109, t111, t1110, t1111, t1113, & - | ^ -note: 't11' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1733:62: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - 1733 | *t697*t662)*t122) - | ^ + 849 | + (t412)*t414*t416*(t287)) + | ^ Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1223:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:653:22: - 1223 | t1089, t109, t1094, t1096, t1099, t11, t110, t1108, t1109, t111, t1110, t1111, t1113, & - | ^ -note: 't109' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1706:40: + 653 | t411 = t3*t10 + | ^ +Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:558:24: - 1706 | t656 = 0.1e1_dp/t654/t101 - | ^ -Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1221:90: + 558 | t240 = t1*ndrho + | ^ +Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5635:90: - 1221 | REAL(KIND=dp) :: ap, bp, cp, d2f0, myrho, myrhoa, myrhob, Qa, Qf, Qp, t1, t100, t101, t1010, & + 5635 | 1.0_dp/Q*(dQrho*dQndrho + d2Qrhondrho) + 1.0_dp/(Q*Q)*dQrho*dQndrho | ^ -note: 't101' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1376:29: - - 1376 | t132 = t1*t131 - | ^ -Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1221:78: +Warning: 'dqrho' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4531:76: - 1221 | REAL(KIND=dp) :: ap, bp, cp, d2f0, myrho, myrhoa, myrhob, Qa, Qf, Qp, t1, t100, t101, t1010, & - | ^ -note: 't1' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1023:48: + 4531 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & + | ^ +note: 'dqrho' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5671:94: - 1023 | t540 = 0.1817120592e1_dp*t98*t221 - | ^ -Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:685:62: + 5671 | 1.0_dp/(Q*Q)*(-Q*dQndrho*dQndrho - Q*d2Qndrhondrho + dQndrho*dQndrho) + | ^ +Warning: 'dqndrho' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4531:69: - 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p - | ^ -note: 't98' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: + 4531 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & + | ^ +note: 'dqndrho' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5146:97: - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:685:57: + 5146 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t283*t545 - t80*(t1319 + t1443)*Clda)*sx + | ^ +Warning: 't545' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: - 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p - | ^ -note: 't97' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:884:30: + 5176 | *t421*t422*t1533 + | ^ +Warning: 't540' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: Warning: 't539' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5195:132: - 884 | t291 = t124*t96 - | ^ -Warning: 't96' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:685:46: + 5195 | *t155*t44*t772) + | ^ +Warning: 't533' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5195:132: Warning: 't530' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: - 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p - | ^ -note: 't96' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1017:28: + 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 + | ^ +Warning: 't526' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: - 1017 | t525 = t95**2 - | ^ -Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:685:23: + 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) + | ^ +Warning: 't522' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: Warning: 't519' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: Warning: 't510' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: - 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p - | ^ -note: 't95' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:924:30: + 5145 | *t155*t44*t726 + | ^ +Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5182:80: - 924 | t357 = t92*t165 - | ^ -Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:685:12: + 5182 | *t367*t405*t1552) + | ^ +Warning: 't501' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5102:26: - 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p - | ^ -note: 't92' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:870:30: - - 870 | t261 = t260*t91 - | ^ -Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:684:97: - - 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & - | ^ -note: 't91' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1005:39: - - 1005 | t499 = 0.1e1_dp/t220/t90 - | ^ -Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:684:92: - - 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & - | ^ -note: 't90' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:684:87: - - 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & - | ^ -note: 't89' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:923:30: - - 923 | t356 = t88*t160 - | ^ -Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:684:82: - - 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & - | ^ -note: 't88' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:836:75: - - 836 | e_b(ip) = e_b(ip) + ((t144 + t213 + t203)*t2 + t42 + t86)*sc - | ^ -Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:684:53: - - 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & - | ^ -note: 't86' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:799:30: - - 799 | t155 = t154*t85 - | ^ -Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:684:36: + 5102 | t1288 = t864*t500 + | ^ +Warning: 't500' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5182:80: - 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & - | ^ -note: 't85' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:972:67: + 5182 | *t367*t405*t1552) + | ^ +Warning: 't498' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: - 972 | *t443*t408)*t80) - t332 + 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) | ^ -Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:683:44: - - 683 | REAL(KIND=dp) :: t792, t793, t798, t80, t800, t804, t807, t808, t810, t814, t820, t823, & - | ^ -note: 't80' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:822:30: - - 822 | t193 = t74*t173 - | ^ -Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:682:18: - - 682 | t732, t74, t743, t745, t748, t752, t755, t758, t769, t78 - | ^ -note: 't74' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:818:30: - - 818 | t187 = t69*t160 - | ^ -Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:681:28: - - 681 | t665, t67, t68, t69, t690, t693, t696, t7, t705, t71, t710, t719, t720, t721, t727, t729, & - | ^ -note: 't69' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1090:39: - - 1090 | t769 = t68**(-0.40e1_dp) - | ^ -Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:681:23: +Warning: 't487' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5076:26: - 681 | t665, t67, t68, t69, t690, t693, t696, t7, t705, t71, t710, t719, t720, t721, t727, t729, & - | ^ -note: 't68' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:972:67: + 5076 | t1181 = t931*t486 + | ^ +Warning: 't486' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: - 972 | *t443*t408)*t80) - t332 + 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) | ^ -Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:681:18: - - 681 | t665, t67, t68, t69, t690, t693, t696, t7, t705, t71, t710, t719, t720, t721, t727, t729, & - | ^ -note: 't67' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:945:39: - - 945 | t402 = 0.1e1_dp/t400/t59 - | ^ -Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:680:47: - - 680 | t567, t570, t573, t58, t583, t589, t59, t595, t596, t6, t601, t603, t613, t62, t625, t64, & - | ^ -note: 't59' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:800:29: - - 800 | t156 = t88*t55 - | ^ -Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:679:77: +Warning: 't484' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: - 679 | t522, t525, t526, t528, t531, t536, t538, t54, t540, t541, t549, t55, t559, t563, t565, & - | ^ -note: 't55' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:826:26: + 5176 | *t421*t422*t1533 + | ^ +Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5120:26: - 826 | t144 + 5120 | t1351 = t476*t420 | ^ -Warning: 't54' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:679:54: - - 679 | t522, t525, t526, t528, t531, t536, t538, t54, t540, t541, t549, t55, t559, t563, t565, & - | ^ -note: 't54' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:827:30: - - 827 | t203 = t51*t202 - | ^ -Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:678:70: - - 678 | t494, t497, t499, t5, t500, t501, t504, t505, t508, t509, t51, t510, t513, t516, t519, & - | ^ -note: 't51' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:764:27: - - 764 | t97 = t5*t96 - | ^ -Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:678:29: - - 678 | t494, t497, t499, t5, t500, t501, t504, t505, t508, t509, t51, t510, t513, t516, t519, & - | ^ -note: 't5' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1165:106: - - 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc - | ^ -Warning: 't490' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:95: - - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't490' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - - 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc - | ^ -Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:84: - - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't489' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1167:32: - - 1167 | t1019 = t488*t202 - | ^ -Warning: 't488' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:78: - - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't488' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - - 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc - | ^ -Warning: 't485' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:72: - - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't485' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - - 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc - | ^ -Warning: 't482' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:66: - - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't482' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1083:47: - - 1083 | t732 = t48**(-0.1666666667e1_dp) - | ^ -Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:60: - - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't48' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - - 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc - | ^ -Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:55: - - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't479' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: +Warning: 't476' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5121:26: - 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc - | ^ + 5121 | t1382 = t136*t475 + | ^ Warning: 't475' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:49: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5151:90: - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't475' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: + 5151 | *t19 + 12._dp*g3*t1*t24*t32) + | ^ +Warning: 't473' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: - 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc - | ^ + 5073 | - (16._dp*t469*t203)) + | ^ Warning: 't472' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:43: - - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't472' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1158:35: - - 1158 | t990 = 0.2e1_dp*t471 - | ^ -Warning: 't471' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:37: - - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't471' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1156:40: - - 1156 | t984 = 0.2e1_dp*t470*t202 - | ^ -Warning: 't470' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:31: - - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't470' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: - - 1176 | + t489)*sc - | ^ -Warning: 't467' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:25: - - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't467' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: - - 1176 | + t489)*sc - | ^ -Warning: 't464' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:19: - - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't464' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: - - 1176 | + t489)*sc - | ^ -Warning: 't461' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: 't469' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: 't468' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: 't465' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: 't464' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: - 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & - | ^ -note: 't461' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: + 5176 | *t421*t422*t1533 + | ^ +Warning: 't459' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: Warning: 't457' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5129:26: - 1176 | + t489)*sc - | ^ -Warning: 't458' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:91: + 5129 | t1413 = t140*t456 + | ^ +Warning: 't456' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: - 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & - | ^ -note: 't458' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1147:35: + 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) + | ^ +Warning: 't454' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: - 1147 | t956 = 0.3e1_dp*t452 - | ^ -Warning: 't452' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:73: + 5096 | - t450*t239 + 2._dp*t85*t706 - t85*t723) + | ^ +Warning: 't453' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: Warning: 't450' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5068:64: - 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & - | ^ -note: 't452' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1157:31: + 5068 | - t80*(t1074 + t1118)*Clda)*sx + | ^ +Warning: 't444' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: - 1157 | t986 = t212*t451 + 5145 | *t155*t44*t726 | ^ -Warning: 't451' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:67: - - 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & - | ^ -note: 't451' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1080:47: - - 1080 | t721 = t45**(-0.1666666667e1_dp) - | ^ -Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:61: - - 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & - | ^ -note: 't45' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ -Warning: 't443' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:56: - - 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & - | ^ -note: 't443' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ -Warning: 't442' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:50: +Warning: 't439' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: - 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & - | ^ -note: 't442' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: + 5176 | *t421*t422*t1533 + | ^ +Warning: 't438' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5042:27: - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ + 5042 | t1049 = t437*t1048 + | ^ Warning: 't437' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:39: - - 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & - | ^ -note: 't437' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ -Warning: 't434' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: - 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & + 5176 | *t421*t422*t1533 | ^ -note: 't434' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: +Warning: 't435' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: Warning: 't434' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5039:30: - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ + 5039 | t1040 = t75/t433/t160 + | ^ Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:27: - - 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & - | ^ -note: 't433' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:794:29: - - 794 | t146 = t43*t91 - | ^ -Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:71: - - 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 - | ^ -note: 't43' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ -Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:66: - - 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 - | ^ -note: 't429' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ + 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 + | ^ Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:60: - - 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 - | ^ -note: 't428' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ -Warning: 't427' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:54: - - 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 - | ^ -note: 't427' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ -Warning: 't425' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:48: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: Warning: 't427' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: - 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 - | ^ -note: 't425' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: + 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) + | ^ +Warning: 't426' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ -Warning: 't424' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:42: + 5145 | *t155*t44*t726 + | ^ +Warning: 't423' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: Warning: 't422' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: - 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 - | ^ -note: 't424' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1114:39: + 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) + | ^ +Warning: 't421' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: - 1114 | *t841 - t187*t851 - | ^ + 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) + | ^ Warning: 't420' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:36: - - 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 - | ^ -note: 't420' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:836:75: - - 836 | e_b(ip) = e_b(ip) + ((t144 + t213 + t203)*t2 + t42 + t86)*sc - | ^ -Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:30: - - 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 - | ^ -note: 't42' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1114:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: - 1114 | *t841 - t187*t851 - | ^ -Warning: 't413' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:25: + 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 + | ^ +Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: - 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 - | ^ -note: 't413' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1114:39: + 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) + | ^ +Warning: 't415' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: - 1114 | *t841 - t187*t851 - | ^ + 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 + | ^ Warning: 't412' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:19: - - 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 - | ^ -note: 't412' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1089:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: - 1089 | t758 = t509*t407 - | ^ -Warning: 't407' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:95: + 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) + | ^ +Warning: 't410' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: - 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & - | ^ -note: 't407' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1094:41: + 5034 | *(t872) + | ^ +Warning: 't406' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5182:80: - 1094 | t800 = t500/t405/t178*t798 - | ^ + 5182 | *t367*t405*t1552) + | ^ Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:89: - - 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & - | ^ -note: 't405' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - - 1144 | *t389*t573*t748 - | ^ -Warning: 't404' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:83: - - 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & - | ^ -note: 't404' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5135:58: - 1144 | *t389*t573*t748 - | ^ -Warning: 't403' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:77: + 5135 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1184) + | ^ +Warning: 't402' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: - 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & - | ^ -note: 't403' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1116:35: + 5034 | *(t872) + | ^ +Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: Warning: 't394' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: - 1116 | t863 = 0.1e1_dp/t400 - | ^ -Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:65: + 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) + | ^ +Warning: 't393' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5128:65: - 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & + 5128 | *t1270 + 0.5e1_dp/0.2e1_dp*(t388)*(t393)*(t1198) | ^ -note: 't400' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1039:46: - - 1039 | t613 = t4**(-0.2333333333e1_dp) - | ^ -Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:59: - - 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & - | ^ -note: 't4' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - - 1144 | *t389*t573*t748 - | ^ -Warning: 't394' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:49: - - 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & - | ^ -note: 't394' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - - 1144 | *t389*t573*t748 - | ^ Warning: 't390' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:37: - - 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & - | ^ -note: 't390' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: - 1144 | *t389*t573*t748 - | ^ + 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 + | ^ Warning: 't389' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: - 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & - | ^ -note: 't389' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: + 5034 | *(t872) + | ^ +Warning: 't388' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: - 1144 | *t389*t573*t748 - | ^ + 5145 | *t155*t44*t726 + | ^ Warning: 't382' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:19: - - 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & - | ^ -note: 't382' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - - 1144 | *t389*t573*t748 - | ^ -Warning: 't381' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:13: - - 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & - | ^ -note: 't381' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - - 1144 | *t389*t573*t748 - | ^ -Warning: 't380' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:95: - - 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & - | ^ -note: 't380' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:908:60: - - 908 | *t325*t287)*t38) - | ^ -Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:89: - - 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & - | ^ -note: 't38' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - - 1144 | *t389*t573*t748 - | ^ -Warning: 't377' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:84: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: - 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & - | ^ -note: 't377' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: + 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) + | ^ +Warning: 't379' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: - 1144 | *t389*t573*t748 - | ^ -Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:78: + 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 + | ^ +Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4992:25: - 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & - | ^ -note: 't376' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: + 4992 | t865 = t864*t374 + | ^ +Warning: 't374' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: - 1144 | *t389*t573*t748 - | ^ + 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 + | ^ Warning: 't373' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:72: - - 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & - | ^ -note: 't373' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1107:62: - - 1107 | *t368*t509 - 0.9531842928e0_dp*t162*t522 - | ^ -Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:66: - - 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & - | ^ -note: 't368' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1099:30: - - 1099 | t814 = t92*t365 - | ^ -Warning: 't365' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:60: - - 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & - | ^ -note: 't365' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - - 1144 | *t389*t573*t748 - | ^ -Warning: 't364' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:54: - - 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & - | ^ -note: 't364' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - - 1144 | *t389*t573*t748 - | ^ -Warning: 't363' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:48: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: - 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & - | ^ -note: 't363' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: + 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) + | ^ +Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5109:35: - 1144 | *t389*t573*t748 - | ^ -Warning: 't357' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:37: + 5109 | *t487 + t1205*t342 + | ^ +Warning: 't369' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4989:116: - 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & - | ^ -note: 't357' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: + 4989 | *t807) + | ^ +Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: - 1144 | *t389*t573*t748 - | ^ -Warning: 't356' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:31: + 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 + | ^ +Warning: 't367' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4989:116: - 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & - | ^ -note: 't356' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1098:31: + 4989 | *t807) + | ^ +Warning: 't360' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5109:35: - 1098 | t810 = t353*t509 - | ^ -Warning: 't353' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:19: + 5109 | *t487 + t1205*t342 + | ^ +Warning: 't359' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4989:116: - 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & - | ^ -note: 't353' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: + 4989 | *t807) + | ^ +Warning: 't355' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: - 1176 | + t489)*sc - | ^ + 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 + | ^ Warning: 't352' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:13: - - 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & - | ^ -note: 't352' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1165:106: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: - 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc - | ^ + 5145 | *t155*t44*t726 + | ^ Warning: 't351' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:96: - - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't351' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1165:106: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: - 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc - | ^ + 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 + | ^ Warning: 't350' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:90: - - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't350' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1084:31: - - 1084 | t743 = t349*t202 - | ^ -Warning: 't349' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:84: - - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't349' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1165:106: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: - 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc - | ^ + 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 + | ^ Warning: 't346' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:78: - - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't346' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1153:89: - - 1153 | + t953 + 0.3e1_dp*t350 + 0.6e1_dp*t351 + t956)*sc - | ^ -Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:72: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5100:32: - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't343' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: + 5100 | t1270 = t345*t127*t1189 + | ^ +Warning: 't345' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5109:35: - 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc - | ^ + 5109 | *t487 + t1205*t342 + | ^ Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:66: - - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't342' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1165:106: - - 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc - | ^ -Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:60: - - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't339' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1165:106: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5016:23: - 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc - | ^ -Warning: 't337' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:54: + 5016 | *(t939) + | ^ +Warning: 't341' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't337' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1153:89: + 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) + | ^ +Warning: 't340' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: - 1153 | + t953 + 0.3e1_dp*t350 + 0.6e1_dp*t351 + t956)*sc - | ^ + 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 + | ^ Warning: 't334' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:48: - - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't334' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5075:26: - 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc - | ^ + 5075 | t1174 = t476*t333 + | ^ Warning: 't333' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:42: - - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't333' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1146:35: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4962:33: - 1146 | t953 = 0.3e1_dp*t332 - | ^ + 4962 | t782 = 0.1e1_dp/t332/t82 + | ^ Warning: 't332' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:36: - - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't332' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - - 1062 | t133*t10 + 0.2e1_dp*t307*t105 - | ^ -Warning: 't325' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:30: - - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't325' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - - 1062 | t133*t10 + 0.2e1_dp*t307*t105 - | ^ -Warning: 't324' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:24: - - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't324' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:789:30: - - 789 | t136 = t32*t114 - | ^ -Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:18: - - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't32' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - - 1062 | t133*t10 + 0.2e1_dp*t307*t105 - | ^ -Warning: 't319' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:13: - - 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & - | ^ -note: 't319' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - - 1062 | t133*t10 + 0.2e1_dp*t307*t105 - | ^ -Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:94: - - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't316' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - - 1062 | t133*t10 + 0.2e1_dp*t307*t105 - | ^ -Warning: 't315' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:88: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't315' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: + 5145 | *t155*t44*t726 + | ^ +Warning: 't330' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5017:25: - 1062 | t133*t10 + 0.2e1_dp*t307*t105 - | ^ -Warning: 't311' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:82: + 5017 | t956 = t136*t329 + | ^ +Warning: 't329' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't311' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: + 5073 | - (16._dp*t469*t203)) + | ^ +Warning: 't327' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: - 1062 | t133*t10 + 0.2e1_dp*t307*t105 - | ^ -Warning: 't310' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:76: + 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) + | ^ +Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't310' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: + 5073 | - (16._dp*t469*t203)) + | ^ +Warning: 't313' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: 't310' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: - 1062 | t133*t10 + 0.2e1_dp*t307*t105 - | ^ + 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) + | ^ Warning: 't309' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:70: - - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't309' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - - 1062 | t133*t10 + 0.2e1_dp*t307*t105 - | ^ -Warning: 't307' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:64: - - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't307' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: - 1062 | t133*t10 + 0.2e1_dp*t307*t105 - | ^ + 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 + | ^ Warning: 't306' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:58: - - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't306' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1051:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: - 1051 | *t531 - t130*t549 - | ^ -Warning: 't302' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:52: + 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) + | ^ +Warning: 't305' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't302' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:831:32: + 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 + | ^ +Warning: 't303' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5021:25: - 831 | t206 = -t3 - t146 - | ^ -Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:46: + 5021 | t985 = t140*t302 + | ^ +Warning: 't302' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't3' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: + 5096 | - t450*t239 + 2._dp*t85*t706 - t85*t723) + | ^ +Warning: 't300' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ + 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) + | ^ Warning: 't299' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:42: - - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't299' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ + 5096 | - t450*t239 + 2._dp*t85*t706 - t85*t723) + | ^ Warning: 't296' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:36: - - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't296' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1043:31: - - 1043 | t693 = t295*t508 - | ^ -Warning: 't295' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:30: - - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't295' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1051:39: - - 1051 | *t531 - t130*t549 - | ^ -Warning: 't292' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:24: - - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't292' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1051:39: - - 1051 | *t531 - t130*t549 - | ^ -Warning: 't291' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:18: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: Warning: 't290' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: - 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & - | ^ -note: 't291' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1034:31: + 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) + | ^ +Warning: 't289' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: - 1034 | t589 = t509*t286 + 5145 | *t155*t44*t726 | ^ Warning: 't286' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:90: - - 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & - | ^ -note: 't286' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1038:41: - - 1038 | t603 = t500/t284/t119*t601 - | ^ -Warning: 't284' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:84: - - 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & - | ^ -note: 't284' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5146:97: - 1078 | *bp*t625*t565*t559 - | ^ + 5146 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t283*t545 - t80*(t1319 + t1443)*Clda)*sx + | ^ Warning: 't283' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:78: - - 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & - | ^ -note: 't283' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't282' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:72: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: - 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & - | ^ -note: 't282' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1035:29: + 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 + | ^ +Warning: 't281' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4959:42: - 1035 | t595 = t279**2 - | ^ + 4959 | t171*t752 - t210*t171*t769 + | ^ Warning: 't279' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:60: - - 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & - | ^ -note: 't279' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't273' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:48: - - 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & - | ^ -note: 't273' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:785:29: - - 785 | t130 = t27*t96 - | ^ -Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:36: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: - 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & - | ^ -note: 't27' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: + 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) + | ^ +Warning: 't278' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't269' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:31: + 4949 | t171*t706 - t210*t171*t723 + | ^ +Warning: 't277' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: - 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & - | ^ -note: 't269' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: + 4943 | t229) - (48._dp*t274*t235)) + | ^ +Warning: 't274' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: 't270' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: 't269' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: 't266' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: 't265' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4959:42: - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't268' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:25: + 4959 | t171*t752 - t210*t171*t769 + | ^ +Warning: 't263' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: - 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & - | ^ -note: 't268' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: + 4949 | t171*t706 - t210*t171*t723 + | ^ +Warning: 't262' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4936:24: - 1078 | *bp*t625*t565*t559 - | ^ + 4936 | t667 = t14*t261 + | ^ Warning: 't261' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:13: - - 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & - | ^ -note: 't261' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't260' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:97: - - 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & - | ^ -note: 't260' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1041:39: - - 1041 | t665 = t26**(-0.40e1_dp) - | ^ -Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:91: - - 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & - | ^ -note: 't26' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't259' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:86: - - 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & - | ^ -note: 't259' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4938:72: - 1144 | *t389*t573*t748 - | ^ + 4938 | - 0.16e2_dp/0.3e1_dp*t257*t196*t199 - (16._dp*t258*t203) + | ^ Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:80: - - 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & - | ^ -note: 't258' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't255' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:74: - - 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & - | ^ -note: 't255' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4938:72: Warning: 't257' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't254' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:68: + 4956 | + 30._dp*a5*t21*t54*t65) + | ^ +Warning: 't256' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4938:72: - 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & - | ^ -note: 't254' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: + 4938 | - 0.16e2_dp/0.3e1_dp*t257*t196*t199 - (16._dp*t258*t203) + | ^ +Warning: 't253' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4938:72: Warning: 't252' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't251' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:62: + 4949 | t171*t706 - t210*t171*t723 + | ^ +Warning: 't249' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4939:24: - 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & - | ^ -note: 't251' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1026:62: + 4939 | t700 = t248*t18 + | ^ +Warning: 't248' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: - 1026 | *t246*t509 - 0.9531842928e0_dp*t102*t522 - | ^ + 5145 | *t155*t44*t726 + | ^ Warning: 't246' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: - 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & - | ^ -note: 't246' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1114:39: + 4949 | t171*t706 - t210*t171*t723 + | ^ +Warning: 't240' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: - 1114 | *t841 - t187*t851 - | ^ -Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:45: + 5096 | - t450*t239 + 2._dp*t85*t706 - t85*t723) + | ^ +Warning: 't239' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4940:30: - 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & - | ^ -note: 't245' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: + 4940 | t706 = t618*t238*t277 + | ^ +Warning: 't238' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ -Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:27: + 4943 | t229) - (48._dp*t274*t235)) + | ^ +Warning: 't235' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: 't229' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: - 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & - | ^ -note: 't241' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1022:49: + 4930 | /t12*t63)) + | ^ +Warning: 't227' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: - 1022 | t538 = 0.1211413728e1_dp*t240*t508 - | ^ -Warning: 't240' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:72: + 4943 | t229) - (48._dp*t274*t235)) + | ^ +Warning: 't223' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: - 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 - | ^ -note: 't240' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:908:60: + 4930 | /t12*t63)) + | ^ +Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: - 908 | *t325*t287)*t38) - | ^ -Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:66: + 4943 | t229) - (48._dp*t274*t235)) + | ^ +Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: - 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 + 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 + | ^ +Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: + + 4930 | /t12*t63)) | ^ -note: 't24' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1013:30: +Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: - 1013 | t513 = t92*t237 - | ^ -Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:61: + 4956 | + 30._dp*a5*t21*t54*t65) + | ^ +Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4921:33: - 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 - | ^ -note: 't237' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: + 4921 | t618 = 0.1e1_dp/t211/t67 + | ^ +Warning: 't211' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4931:30: - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't236' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:55: + 4931 | t657 = t210*t171*t655 + | ^ +Warning: 't210' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: - 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 - | ^ -note: 't236' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: + 4949 | t171*t706 - t210*t171*t723 + | ^ +Warning: 't208' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4904:35: - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't235' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:49: + 4904 | t575 = 4._dp*t11*t179*t207 + | ^ +Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4897:24: - 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 - | ^ -note: 't235' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1100:31: + 4897 | t558 = t14*t206 + | ^ +Warning: 't206' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: - 1100 | t820 = t231*t165 - | ^ -Warning: 't231' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:43: + 5073 | - (16._dp*t469*t203)) + | ^ +Warning: 't203' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4913:25: - 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 - | ^ -note: 't231' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: + 4913 | t599 = t198*t192 + | ^ +Warning: 't198' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: - 1176 | + t489)*sc - | ^ -Warning: 't230' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:37: + 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) + | ^ +Warning: 't197' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: - 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 - | ^ -note: 't230' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: + 5073 | - (16._dp*t469*t203)) + | ^ +Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't226' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:31: + 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) + | ^ +Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: - 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 - | ^ -note: 't226' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: + 5073 | - (16._dp*t469*t203)) + | ^ +Warning: 't189' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4905:23: - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't225' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:25: + 4905 | t576 = t4*t188 + | ^ +Warning: 't188' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: - 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 - | ^ -note: 't225' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1096:31: + 5073 | - (16._dp*t469*t203)) + | ^ +Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: - 1096 | t807 = t222*t165 - | ^ -Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:13: + 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) + | ^ +Warning: 't184' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: - 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 - | ^ -note: 't222' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: + 5073 | - (16._dp*t469*t203)) + | ^ +Warning: 't183' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: - 1176 | + t489)*sc - | ^ -Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:94: + 4949 | t171*t706 - t210*t171*t723 + | ^ +Warning: 't180' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: - 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & - | ^ -note: 't221' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1005:39: + 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) + | ^ +Warning: 't179' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: - 1005 | t499 = 0.1e1_dp/t220/t90 - | ^ -Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:88: + 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) + | ^ +Warning: 't178' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4911:34: - 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & - | ^ -note: 't220' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1012:31: + 4911 | t594 = t56*r3*t58*t5*t177 + | ^ +Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: - 1012 | t510 = t217*t509 - | ^ -Warning: 't217' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:70: + 4949 | t171*t706 - t210*t171*t723 + | ^ +Warning: 't174' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: Warning: 't173' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4924:36: - 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & - | ^ -note: 't217' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1009:35: + 4924 | t623 = 2._dp*t210*t171*t620 + | ^ +Warning: 't171' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: - 1009 | t505 = t216*t96*t504 - | ^ -Warning: 't216' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:64: + 4949 | t171*t706 - t210*t171*t723 + | ^ +Warning: 't170' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4935:25: - 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & - | ^ -note: 't216' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:999:102: + 4935 | t664 = t248*t169 + | ^ +Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: - 999 | e_bb(ip) = e_bb(ip) + ((t332 + t489 + t490 + t452)*t2 + t455 + 0.2e1_dp*t213 + t457)*sc - | ^ -Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:58: + 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) + | ^ +Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: 't96' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5135:58: - 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + 5135 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1184) | ^ -note: 't213' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1157:31: - - 1157 | t986 = t212*t451 - | ^ -Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:52: +Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: - 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & - | ^ -note: 't212' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: + 5176 | *t421*t422*t1533 + | ^ +Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: - 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc - | ^ -Warning: 't209' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:41: + 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) + | ^ +Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4784:22: - 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & - | ^ -note: 't209' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: + 4784 | t332 = t92**2 + | ^ +Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: - 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc + 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) | ^ -Warning: 't206' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:35: - - 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & - | ^ -note: 't206' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:975:35: - - 975 | t457 = 0.2e1_dp*t203 - | ^ -Warning: 't203' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:29: +Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5023:29: - 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + 5023 | t995 = t140*t90*t108 | ^ -note: 't203' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1156:40: +Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4925:32: - 1156 | t984 = 0.2e1_dp*t470*t202 - | ^ -Warning: 't202' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:23: + 4925 | t632 = 0.1e1_dp/t9/t594 + | ^ +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: - 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & - | ^ -note: 't202' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:836:75: + 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) + | ^ +Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: - 836 | e_b(ip) = e_b(ip) + ((t144 + t213 + t203)*t2 + t42 + t86)*sc - | ^ -Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:17: + 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) + | ^ +Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: - 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & - | ^ -note: 't2' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: + 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) + | ^ +Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5109:35: - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ -Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:13: + 5109 | *t487 + t1205*t342 + | ^ +Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: - 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & - | ^ -note: 't194' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:963:31: + 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) + | ^ +Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4962:33: - 963 | t437 = t193*t245 - | ^ -Warning: 't193' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:96: + 4962 | t782 = 0.1e1_dp/t332/t82 + | ^ +Warning: 't82' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5196:71: - 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & - | ^ -note: 't193' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: + 5196 | e_ndrho_ndrho = e_ndrho_ndrho + (-t80*(t1576 + t1672)*Clda)*sx + | ^ +Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4912:27: - 1128 | - 0.1588640487e1_dp*t437*t860 - | ^ -Warning: 't191' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:90: + 4912 | t597 = t24/t8/t594 + | ^ +Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4961:22: - 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & - | ^ -note: 't191' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:957:31: + 4961 | t774 = t78**2 + | ^ +Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5040:23: - 957 | t425 = t424*t190 - | ^ -Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:84: + 5040 | t1047 = t75**2 + | ^ +Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4933:67: - 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & - | ^ -note: 't190' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:959:31: + 4933 | + t623 - t657 + 0.10e2_dp/0.9e1_dp*t73*t219*t56*t58 + | ^ +Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4978:64: - 959 | t428 = t189*t427 - | ^ -Warning: 't189' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:73: + 4978 | + t623 - t657 + 0.10e2_dp/0.9e1_dp*t72*t219*t192 + | ^ +Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4757:53: - 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & - | ^ -note: 't189' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:956:43: + 4757 | t281 = 2._dp*t249*t70 + t11*t263 - t210*t279 + | ^ +Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4903:34: - 956 | t420*t365 - t187*t373 - | ^ -Warning: 't187' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:67: + 4903 | t572 = 6._dp*t11*t569*t69 + | ^ +Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: - 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & - | ^ -note: 't187' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1114:39: + 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) + | ^ +Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4720:22: - 1114 | *t841 - t187*t851 - | ^ -Warning: 't184' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:61: + 4720 | t211 = t67**2 + | ^ +Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: - 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & - | ^ -note: 't184' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:943:31: + 4956 | + 30._dp*a5*t21*t54*t65) + | ^ +Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: - 943 | t397 = t231*t179 + 4930 | /t12*t63)) + | ^ +Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4730:31: + + 4730 | t235 = t60/t61/rho*t63 | ^ -Warning: 't179' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:43: +Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: - 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & - | ^ -note: 't179' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1094:41: + 4930 | /t12*t63)) + | ^ +Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: - 1094 | t800 = t500/t405/t178*t798 - | ^ -Warning: 't178' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:37: + 4956 | + 30._dp*a5*t21*t54*t65) + | ^ +Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: - 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & - | ^ -note: 't178' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1093:29: + 4930 | /t12*t63)) + | ^ +Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4914:26: - 1093 | t798 = t176**2 - | ^ -Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:31: + 4914 | t603 = t46*t31*t6 + | ^ +Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: - 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & - | ^ -note: 't176' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: + 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) + | ^ +Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: - 1144 | *t389*t573*t748 - | ^ -Warning: 't175' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:25: + 4930 | /t12*t63)) + | ^ +Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4905:23: - 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & - | ^ -note: 't175' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:942:31: + 4905 | t576 = t4*t188 + | ^ +Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: - 942 | t394 = t174*t245 - | ^ -Warning: 't174' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:19: + 4930 | /t12*t63)) + | ^ +Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4753:26: - 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & - | ^ -note: 't174' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1117:40: + 4753 | t274 = a5*t38*t54 + | ^ +Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: - 1117 | t872 = 0.1e1_dp/t400/t172 - | ^ -Warning: 't172' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:95: + 4930 | /t12*t63)) + | ^ +Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4900:24: - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't172' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: + 4900 | t564 = t34*t212 + | ^ +Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5151:90: - 1144 | *t389*t573*t748 - | ^ -Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:89: + 5151 | *t19 + 12._dp*g3*t1*t24*t32) + | ^ +Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4915:28: - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't169' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:935:31: + 4915 | t607 = t27*t227*t31 + | ^ +Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4902:23: - 935 | t380 = t168*t258 - | ^ -Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:83: + 4902 | t569 = t29*t14 + | ^ +Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't168' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:972:67: + 4930 | /t12*t63)) + | ^ +Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4915:28: - 972 | *t443*t408)*t80) - t332 - | ^ -Warning: 't165' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:77: + 4915 | t607 = t27*t227*t31 + | ^ +Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't165' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1107:62: + 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) + | ^ +Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: - 1107 | *t368*t509 - 0.9531842928e0_dp*t162*t522 - | ^ -Warning: 't162' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:71: + 4956 | + 30._dp*a5*t21*t54*t65) + | ^ +Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4857:47: - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't162' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: + 4857 | t472 = 2._dp*t465*t19 + 4._dp*t469*t32 + | ^ +Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4939:24: - 1144 | *t389*t573*t748 - | ^ -Warning: 't161' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:65: + 4939 | t700 = t248*t18 + | ^ +Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't161' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:923:30: + 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5068:64: - 923 | t356 = t88*t160 - | ^ -Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:59: + 5068 | - t80*(t1074 + t1118)*Clda)*sx + | ^ +Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't160' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:878:39: + 5176 | *t421*t422*t1533 + | ^ +Warning: 't161' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: - 878 | t281 = 0.1e1_dp/t279/t16 - | ^ + 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) + | ^ Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:53: - - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't16' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1102:29: - - 1102 | t835 = t159**2 - | ^ -Warning: 't159' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:48: - - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't159' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5195:132: - 1144 | *t389*t573*t748 - | ^ + 5195 | *t155*t44*t772) + | ^ Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:42: - - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't156' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:989:48: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: - 989 | + t213)*sc - | ^ + 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) + | ^ Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:36: - - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't155' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1085:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: - 1085 | t745 = t154*t451 - | ^ + 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) + | ^ Warning: 't154' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:30: - - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't154' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:981:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: - 981 | t464 = t342*t151 - | ^ + 5176 | *t421*t422*t1533 + | ^ Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:24: - - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't151' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:982:30: - - 982 | t467 = t150*t43 - | ^ -Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:18: - - 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & - | ^ -note: 't150' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:979:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: - 979 | t458 = t333*t147 - | ^ -Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:96: + 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) + | ^ +Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: - 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & - | ^ -note: 't147' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:980:30: + 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) + | ^ +Warning: 't146' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: - 980 | t461 = t145*t43 - | ^ + 5176 | *t421*t422*t1533 + | ^ Warning: 't145' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:84: - - 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & - | ^ -note: 't145' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:974:35: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4990:25: - 974 | t455 = 0.2e1_dp*t144 - | ^ -Warning: 't144' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:78: + 4990 | t863 = t125*t141 + | ^ +Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: - 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & - | ^ -note: 't144' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: + 5073 | - (16._dp*t469*t203)) + | ^ +Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5122:26: - 1062 | t133*t10 + 0.2e1_dp*t307*t105 - | ^ + 5122 | t1397 = t136*t137 + | ^ Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:67: - - 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & - | ^ -note: 't137' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:899:31: - - 899 | t319 = t136*t245 - | ^ -Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:61: - - 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & - | ^ -note: 't136' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5195:132: - 1062 | t133*t10 + 0.2e1_dp*t307*t105 - | ^ + 5195 | *t155*t44*t772) + | ^ Warning: 't134' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:55: - - 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & - | ^ -note: 't134' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:893:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: - 893 | t307 = t306*t133 - | ^ + 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) + | ^ Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:49: - - 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & - | ^ -note: 't133' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:895:31: - - 895 | t310 = t132*t309 - | ^ -Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:43: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4959:42: - 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & - | ^ -note: 't132' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:892:43: + 4959 | t171*t752 - t210*t171*t769 + | ^ +Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5182:80: - 892 | t302*t237 - t130*t251 - | ^ -Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:37: + 5182 | *t367*t405*t1552) + | ^ +Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4995:39: - 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & - | ^ -note: 't130' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:972:67: + 4995 | t878 = 0.1e1_dp/t128/t115/t114 + | ^ +Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: - 972 | *t443*t408)*t80) - t332 - | ^ + 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 + | ^ Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:31: - - 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & - | ^ -note: 't127' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:888:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5098:26: - 888 | t299 = t126*t230 - | ^ + 5098 | t1264 = t125*t126 + | ^ Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:25: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: - 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & - | ^ -note: 't126' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1051:39: + 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 + | ^ +Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4975:34: - 1051 | *t531 - t130*t549 - | ^ -Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:19: + 4975 | t811 = 0.1e1_dp/t121/t114 + | ^ +Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4696:23: - 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & - | ^ -note: 't125' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:876:31: + 4696 | t177 = t12*rho + | ^ +Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: - 876 | t276 = t231*t120 + 5145 | *t155*t44*t726 | ^ -Warning: 't120' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:91: - - 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & - | ^ -note: 't120' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1038:41: - - 1038 | t603 = t500/t284/t119*t601 - | ^ -Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:85: - - 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & - | ^ -note: 't119' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1037:29: +Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4966:39: - 1037 | t601 = t117**2 - | ^ + 4966 | t792 = 0.1e1_dp/t117/t789/t114 + | ^ Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:79: - - 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & - | ^ -note: 't117' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4790:34: - 1078 | *bp*t625*t565*t559 - | ^ + 4790 | t345 = 0.1e1_dp/t117/t116 + | ^ Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:73: - - 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & - | ^ -note: 't116' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:875:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: - 875 | t273 = t115*t245 - | ^ + 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 + | ^ Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:67: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5079:32: - 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & - | ^ -note: 't115' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1028:40: + 5079 | t1190 = t372*t114*t1189 + | ^ +Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5101:32: - 1028 | t563 = 0.1e1_dp/t279/t113 - | ^ + 5101 | t1277 = t372*t113*t1189 + | ^ Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:55: - - 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & - | ^ -note: 't113' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - - 1078 | *bp*t625*t565*t559 - | ^ -Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:49: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5082:26: - 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & - | ^ -note: 't110' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:758:28: + 5082 | t1208 = t110*t111 + | ^ +Warning: 't111' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: - 758 | t89 = t88*t11 - | ^ + 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) + | ^ Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:43: - - 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & - | ^ -note: 't11' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:866:31: - - 866 | t255 = t254*t109 - | ^ -Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:38: - - 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & - | ^ -note: 't109' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:868:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: - 868 | t259 = t108*t258 - | ^ + 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) + | ^ Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: - 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & - | ^ -note: 't108' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:908:60: + 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) + | ^ +Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5019:30: - 908 | *t325*t287)*t38) - | ^ + 5019 | t966 = t136*t105*t108 + | ^ Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5151:90: - 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & - | ^ -note: 't105' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1026:62: + 5151 | *t19 + 12._dp*g3*t1*t24*t32) + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: - 1026 | *t246*t509 - 0.9531842928e0_dp*t102*t522 - | ^ + 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) + | ^ Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:13: - - 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & - | ^ -note: 't102' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:885:31: - - 885 | t292 = t291*t101 - | ^ -Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:662:85: - - 662 | REAL(KIND=dp) :: ap, bp, cp, myrho, myrhoa, myrhob, Qf, Qp, t1, t10, t100, t101, t1019, & - | ^ -note: 't101' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:792:82: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: 't100' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4740:24: - 792 | t121 - t24*(t134*t10 + 0.3177280975e0_dp*t137*t121)*t38) - | ^ + 4740 | t249 = t248*t10 + | ^ Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:662:73: - - 662 | REAL(KIND=dp) :: ap, bp, cp, myrho, myrhoa, myrhob, Qf, Qp, t1, t10, t100, t101, t1019, & - | ^ -note: 't10' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_vwn.mod' due to: xc_vwn.o /build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod xc_input_constants.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_tfw.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_tfw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod cp_array_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_tfw.F xc_tfw.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:06:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_tfw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_tfw.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_tfw.mod' due to: xc_tfw.o /build/reproducible-path/cp2k-8.1/src/xc/xc_tfw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod cp_array_utils.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_perdew_wang.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod xc_input_constants.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F xc_perdew_wang.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:06:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_perdew_wang.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_perdew_wang.F90 -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:632:65: - - 632 | + trz*r(1)*z(0, 2) + tzz*z(0, 2)*z(1, 0) + tz*z(1, 2) - | ^ -Warning: 'tzz' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:496:63: - - 496 | tzz, tzzz - | ^ -note: 'tzz' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:603:56: - - 603 | + tr*r(2) + tzz*z(1, 0)**2 + tz*z(2, 0) - | ^ -Warning: 'trz' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:89: - - 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -note: 'trz' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:603:56: - - 603 | + tr*r(2) + tzz*z(1, 0)**2 + tz*z(2, 0) - | ^ -Warning: 'trr' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:72: - - 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -note: 'trr' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:99: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4743:24: - 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -Warning: 'tz' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:597:37: + 4743 | t256 = t1*ndrho + | ^ +Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5635:90: - 597 | ed(m) = tr*r(1) + tz*z(1, 0) - | ^ -Warning: 'tr' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:67: + 5635 | 1.0_dp/Q*(dQrho*dQndrho + d2Qrhondrho) + 1.0_dp/(Q*Q)*dQrho*dQndrho + | ^ +Warning: 'dqrho' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3649:76: - 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -note: 'tr' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:638:53: + 3649 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t1004, & + | ^ +note: 'dqrho' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5671:94: - 638 | + 3.0_dp*tzz*z(0, 1)*z(0, 2) + tz*z(0, 3) - | ^ -Warning: 'tzzz' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:496:69: + 5671 | 1.0_dp/(Q*Q)*(-Q*dQndrho*dQndrho - Q*d2Qndrhondrho + dQndrho*dQndrho) + | ^ +Warning: 'dqndrho' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3649:69: - 496 | tzz, tzzz + 3649 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t1004, & | ^ -note: 'tzzz' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:624:65: - - 624 | + trz*r(1)*z(2, 0) + tzz*z(2, 0)*z(0, 1) + tz*z(2, 1) - | ^ -Warning: 'trzz' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:95: - - 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -note: 'trzz' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:616:53: - - 616 | + 3.0_dp*tzz*z(1, 0)*z(2, 0) + tz*z(3, 0) - | ^ -Warning: 'trrz' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:84: - - 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -note: 'trrz' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:616:53: - - 616 | + 3.0_dp*tzz*z(1, 0)*z(2, 0) + tz*z(3, 0) - | ^ -Warning: 'trrr' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F:495:78: - - 495 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -note: 'trrr' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_perdew_wang.mod' due to: xc_perdew_wang.o /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.F /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod xc_input_constants.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_thomas_fermi.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_thomas_fermi.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod cp_array_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_thomas_fermi.F xc_thomas_fermi.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:06:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_thomas_fermi.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_thomas_fermi.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_thomas_fermi.mod' due to: xc_thomas_fermi.o /build/reproducible-path/cp2k-8.1/src/xc/xc_thomas_fermi.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod cp_array_utils.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_ke_gga.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_ke_gga.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod mathconstants.mod base_hooks.mod xc_input_constants.mod cp_array_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_ke_gga.F xc_ke_gga.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:06:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_ke_gga.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_ke_gga.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_ke_gga.mod' due to: xc_ke_gga.o /build/reproducible-path/cp2k-8.1/src/xc/xc_ke_gga.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod mathconstants.mod base_hooks.mod xc_input_constants.mod cp_array_utils.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xbecke88_long_range.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod cp_array_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F xc_xbecke88_long_range.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:06:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbecke88_long_range.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbecke88_long_range.F90 -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: - - 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 - | ^ -Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:72: - - 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 - | ^ -note: 't98' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1261:104: - - 1261 | *t68*t259 - 0.2222222224e0_dp*t24*t98*t358)*sx - | ^ -Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:61: - - 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 - | ^ -note: 't95' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1313:70: - - 1313 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 - | ^ -Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:56: - - 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 - | ^ -note: 't94' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1276:72: - - 1276 | *t11*t91 + 0.40e1_dp*t382*t384 - 0.20e1_dp*t6*t401 - | ^ -Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:45: - - 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 - | ^ -note: 't91' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1202:30: - - 1202 | t226 = t225*t90 - | ^ -Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:40: - - 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 - | ^ -note: 't90' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1273:55: - - 1273 | t87 + 0.8000000000e1_dp*t393*t397 - | ^ -Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:29: - - 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 - | ^ -note: 't87' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1328:66: - - 1328 | t525 = 0.120e2_dp*t508*t86 - 0.60e1_dp*t6*t521*t250 - | ^ -Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1057:12: - - 1057 | t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961, t98 - | ^ -note: 't86' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1375:39: - - 1375 | t669 = 0.1e1_dp/t85/t667 - | ^ -Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:89: - - 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & - | ^ -note: 't85' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1374:28: - - 1374 | t667 = t84**2 - | ^ -Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:72: - - 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & - | ^ -note: 't84' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1159:28: - - 1159 | t140 = t8*rho - | ^ -Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:61: - - 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & - | ^ -note: 't8' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1393:67: - - 1393 | *t128*t43*t677 - 0.2666666667e1_dp*t42*pi*t79 - | ^ -Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:45: - - 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & - | ^ -note: 't79' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1215:30: +note: 'dqndrho' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4430:97: - 1215 | t255 = t77*t254 - | ^ -Warning: 't77' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:40: + 4430 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t322*t696 - t80*(t1652 + t1860)*Clda)*sx + | ^ +Warning: 't696' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: - 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & - | ^ -note: 't77' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: + 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) + | ^ +Warning: 't691' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: Warning: 't690' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: - 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:29: + 4461 | - (4._dp*t568*t570) + | ^ +Warning: 't684' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: Warning: 't681' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: - 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & - | ^ -note: 't76' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1370:28: + 4376 | *t320 + | ^ +Warning: 't677' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: - 1370 | t639 = t75**2 - | ^ -Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1056:24: + 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) + | ^ +Warning: 't673' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: Warning: 't670' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: Warning: 't664' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: Warning: 't661' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: - 1056 | t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, t857, & - | ^ -note: 't75' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1276:72: + 4376 | *t320 + | ^ +Warning: 't656' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: - 1276 | *t11*t91 + 0.40e1_dp*t382*t384 - 0.20e1_dp*t6*t401 - | ^ -Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:84: + 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) + | ^ +Warning: 't652' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4377:27: - 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & - | ^ -note: 't72' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: + 4377 | t1675 = t1241*t651 + | ^ +Warning: 't651' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: - 1442 | *t244*ndrho/t657/t7*t669) - | ^ -Warning: 't71' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:73: + 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) + | ^ +Warning: 't649' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4481:25: - 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & - | ^ -note: 't71' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1120:27: + 4481 | *(t1886) + | ^ +Warning: 't638' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4383:27: - 1120 | t69 = t7*rho + 4383 | t1695 = t1203*t637 | ^ -Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:68: +Warning: 't637' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: - 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & + 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) | ^ -note: 't7' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1382:63: +Warning: 't635' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: - 1382 | /t69*t669) - | ^ -Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:64: + 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) + | ^ +Warning: 't629' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4366:26: - 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & - | ^ -note: 't69' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: + 4366 | t1645 = t627*t531 + | ^ +Warning: 't627' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4405:26: - 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:53: + 4405 | t1781 = t176*t626 + | ^ +Warning: 't626' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: - 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & - | ^ -note: 't68' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: + 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) + | ^ +Warning: 't623' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4357:26: - 1553 | t98*t1400 - | ^ -Warning: 't64' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1055:12: + 4357 | t1583 = t621*t142 + | ^ +Warning: 't621' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: - 1055 | t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, t735, & - | ^ -note: 't64' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1172:84: + 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) + | ^ +Warning: 't617' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't616' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't612' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: - 1172 | 0.2222222224e0_dp*t24*t98*t155)*sx - | ^ -Warning: 't60' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:45: + 4356 | t419*t77*t871)/0.2e1_dp) + | ^ +Warning: 't611' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't610' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: - 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & - | ^ -note: 't60' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: + 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) + | ^ +Warning: 't608' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4341:47: - 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) - | ^ -Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:40: + 4341 | + t1079*t210*t1080*t316) + | ^ +Warning: 't607' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: - 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & - | ^ -note: 't6' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1498:31: + 4356 | t419*t77*t871)/0.2e1_dp) + | ^ +Warning: 't604' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't599' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: - 1498 | t1153 = t27*t590 - | ^ -Warning: 't590' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:36: + 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) + | ^ +Warning: 't596' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: - 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & - | ^ -note: 't590' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: + 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) + | ^ +Warning: 't595' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't593' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: - 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:30: + 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) + | ^ +Warning: 't592' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: Warning: 't590' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4330:26: - 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & - | ^ -note: 't59' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: + 4330 | t1480 = t589*t373 + | ^ +Warning: 't589' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: - 1544 | *t36*t38*t1396 - | ^ + 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) + | ^ Warning: 't586' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:25: - - 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & - | ^ -note: 't586' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - - 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't580' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:19: - - 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & - | ^ -note: 't580' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - - 1544 | *t36*t38*t1396 - | ^ -Warning: 't576' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1054:13: - - 1054 | t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, t639, & - | ^ -note: 't576' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't575' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:96: - - 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & - | ^ -note: 't575' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - - 1544 | *t36*t38*t1396 - | ^ -Warning: 't574' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:90: - - 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & - | ^ -note: 't574' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - - 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't573' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:84: - - 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & - | ^ -note: 't573' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't572' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:78: - - 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & - | ^ -note: 't572' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't584' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't571' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:72: + 4461 | - (4._dp*t568*t570) + | ^ +Warning: 't570' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: Warning: 't568' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: - 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & - | ^ -note: 't571' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: + 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) + | ^ +Warning: 't567' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4432:111: - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't570' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:66: + 4432 | t68 - 2._dp*t561*t317 + 2._dp*t85*t900 - t85*t917) + | ^ +Warning: 't565' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: - 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & - | ^ -note: 't570' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: + 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) + | ^ +Warning: 't564' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: Warning: 't561' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4324:64: - 1544 | *t36*t38*t1396 - | ^ -Warning: 't566' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:60: + 4324 | - t80*(t1189 + t1408)*Clda)*sx + | ^ +Warning: 't555' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: - 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & - | ^ -note: 't566' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: + 4376 | *t320 + | ^ +Warning: 't550' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: - 1544 | *t36*t38*t1396 - | ^ -Warning: 't562' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:54: + 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) + | ^ +Warning: 't549' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4312:27: - 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & - | ^ -note: 't562' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1169:26: + 4312 | t1402 = t548*t1401 + | ^ +Warning: 't548' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: - 1169 | t151 - | ^ -Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:48: + 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) + | ^ +Warning: 't546' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: Warning: 't545' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4309:30: - 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & - | ^ -note: 't55' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: + 4309 | t1393 = t75/t544/t199 + | ^ +Warning: 't544' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4248:21: - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ + 4248 | *t58 + | ^ Warning: 't539' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:43: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: - 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & - | ^ -note: 't539' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: + 4429 | *t461*t320) - (2._dp*t91*t344*t875) + | ^ +Warning: 't538' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ + 4322 | *t199*t285 + t550*t285)) + | ^ Warning: 't537' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:37: - - 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & - | ^ -note: 't537' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't536' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:31: - - 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & - | ^ -note: 't536' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: - 1553 | t98*t1400 - | ^ -Warning: 't530' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1053:13: + 4376 | *t320 + | ^ +Warning: 't534' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: Warning: 't533' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: - 1053 | t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, t575, & - | ^ -note: 't530' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1586:49: + 4461 | - (4._dp*t568*t570) + | ^ +Warning: 't532' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: - 1586 | *sx - | ^ -Warning: 't529' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:93: + 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) + | ^ +Warning: 't531' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't529' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: + 4376 | *t320 + | ^ +Warning: 't528' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: - 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) - | ^ + 4322 | *t199*t285 + t550*t285)) + | ^ Warning: 't526' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:87: - - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't526' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - - 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't525' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:81: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't525' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: + 4376 | *t320 + | ^ +Warning: 't523' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: - 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) - | ^ + 4322 | *t199*t285 + t550*t285)) + | ^ Warning: 't521' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:75: - - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't521' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1184:59: - - 1184 | *t52 - 0.5000000001e0_dp*t41*t172*t46 - | ^ -Warning: 't52' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:69: - - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't52' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1367:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4278:38: - 1367 | t624 = 0.1e1_dp/t8/t519 + 4278 | (t511)*(t516)*(t1260) | ^ -Warning: 't519' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:64: - - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't519' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - - 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't514' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:58: +Warning: 't517' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't514' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: + 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) + | ^ +Warning: 't516' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4419:65: - 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) - | ^ + 4419 | *t1739 + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t1712) + | ^ Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:52: - - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't513' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1244:33: - - 1244 | t339 = t48*t10*t51 - | ^ -Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:46: - - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't51' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - - 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't508' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:41: - - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't508' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: - - 1553 | t98*t1400 - | ^ -Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:35: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4295:78: - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't505' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: + 4295 | t478*t512*t969) + | ^ +Warning: 't512' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4278:38: - 1553 | t98*t1400 - | ^ -Warning: 't502' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:29: + 4278 | (t511)*(t516)*(t1260) + | ^ +Warning: 't511' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4278:38: Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4481:25: - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't502' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1586:49: + 4481 | *(t1886) + | ^ +Warning: 't504' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4412:70: - 1586 | *sx - | ^ + 4412 | t1796*t1762 + 0.5e1_dp/0.2e1_dp*(t499)*(t504)*(t1632) + | ^ Warning: 't501' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:23: - - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't501' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1382:63: - - 1382 | /t69*t669) - | ^ -Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:17: - - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't5' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1431:30: - - 1431 | t857 = t27*t496 - | ^ -Warning: 't496' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1052:13: - - 1052 | t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, t529, & - | ^ -note: 't496' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1485:76: - - 1485 | + t1136) - | ^ -Warning: 't492' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:96: - - 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & - | ^ -note: 't492' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4305:31: - 1456 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:90: + 4305 | *(t457)*(t933) + | ^ +Warning: 't500' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4278:38: - 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & - | ^ -note: 't49' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: + 4278 | (t511)*(t516)*(t1260) + | ^ +Warning: 't499' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: - 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:85: + 4376 | *t320 + | ^ +Warning: 't493' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: - 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & - | ^ -note: 't489' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: + 4322 | *t199*t285 + t550*t285)) + | ^ +Warning: 't490' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4404:124: - 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ + 4404 | *t471*t875)/0.2e1_dp + (10._dp*t1685*t1762) + | ^ Warning: 't486' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:79: - - 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & - | ^ -note: 't486' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4263:27: - 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't482' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:73: + 4263 | t1242 = t1241*t485 + | ^ +Warning: 't485' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: - 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & - | ^ -note: 't482' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: + 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) + | ^ +Warning: 't484' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: - 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:62: + 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) + | ^ +Warning: 't483' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4404:124: - 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & - | ^ -note: 't479' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1470:68: + 4404 | *t471*t875)/0.2e1_dp + (10._dp*t1685*t1762) + | ^ +Warning: 't480' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: - 1470 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 + 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) | ^ -Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:56: - - 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & - | ^ -note: 't478' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: +Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: - 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't473' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:50: + 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) + | ^ +Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4295:78: - 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & - | ^ -note: 't473' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1470:68: + 4295 | t478*t512*t969) + | ^ +Warning: 't471' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: - 1470 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 - | ^ + 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) + | ^ Warning: 't470' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:44: - - 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & - | ^ -note: 't470' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1406:40: - - 1406 | REAL(t46, KIND=dp) - | ^ -Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:38: - - 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & - | ^ -note: 't47' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - - 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't467' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:33: - - 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & - | ^ -note: 't467' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4295:78: - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ + 4295 | t478*t512*t969) + | ^ Warning: 't466' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1051:27: - - 1051 | REAL(kind=dp) :: t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, t492, & - | ^ -note: 't466' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - - 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't465' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:71: - - 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 - | ^ -note: 't465' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - - 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't464' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:65: - - 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 - | ^ -note: 't464' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: - 1477 | t41*t328*t466 - | ^ + 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) + | ^ Warning: 't463' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:59: - - 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 - | ^ -note: 't463' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4252:27: - 1477 | t41*t328*t466 - | ^ + 4252 | t1204 = t1203*t462 + | ^ Warning: 't462' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:53: - - 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 - | ^ -note: 't462' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - - 1456 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't460' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:47: - - 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 - | ^ -note: 't460' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1184:59: - - 1184 | *t52 - 0.5000000001e0_dp*t41*t172*t46 - | ^ -Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:41: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: - 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 - | ^ -note: 't46' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: + 4429 | *t461*t320) - (2._dp*t91*t344*t875) + | ^ +Warning: 't461' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4404:124: - 1456 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ + 4404 | *t471*t875)/0.2e1_dp + (10._dp*t1685*t1762) + | ^ Warning: 't457' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:36: - - 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 - | ^ -note: 't457' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4397:32: - 1456 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't455' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:30: + 4397 | t1762 = t456*t168*t1687 + | ^ +Warning: 't456' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: - 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 - | ^ -note: 't455' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1514:57: + 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) + | ^ +Warning: 't453' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4305:31: - 1514 | + 0.5999999999e1_dp*t128*t132*t529 - | ^ + 4305 | *(t457)*(t933) + | ^ Warning: 't452' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:24: - - 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 - | ^ -note: 't452' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4481:25: - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ + 4481 | *(t1886) + | ^ Warning: 't451' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:18: - - 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 - | ^ -note: 't451' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1139:49: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: - 1139 | t103 = EXP(-0.9000000000e1_dp*t44) - | ^ -Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1050:12: + 4429 | *t461*t320) - (2._dp*t91*t344*t875) + | ^ +Warning: 't445' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4364:26: - 1050 | t44, t451, t452, t455, t457, t46, t460, t462, t463, t464, t465 - | ^ -note: 't44' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: + 4364 | t1627 = t627*t444 + | ^ +Warning: 't444' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: - 1544 | *t36*t38*t1396 - | ^ -Warning: 't435' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:94: + 4376 | *t320 + | ^ +Warning: 't442' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4297:26: - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & - | ^ -note: 't435' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1153:34: + 4297 | t1350 = t151*t441 + | ^ +Warning: 't441' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4360:49: - 1153 | t130 = t128*t43*t94 - | ^ -Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:88: + 4360 | 0.7e1_dp/0.2e1_dp*t435*t437*t875 + | ^ +Warning: 't438' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4360:49: Warning: 't437' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4360:49: Warning: 't435' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4216:26: - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & - | ^ -note: 't43' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: + 4216 | t1143 = t433*t142 + | ^ +Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: - 1544 | *t36*t38*t1396 - | ^ + 4356 | t419*t77*t871)/0.2e1_dp) + | ^ Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:83: - - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & - | ^ -note: 't429' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - - 1456 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:77: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't424' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & - | ^ -note: 't428' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1155:30: + 4234 | *(t435)*(t437)*(t976) + | ^ +Warning: 't423' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: - 1155 | t133 = t42*t132 - | ^ -Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:71: + 4356 | t419*t77*t871)/0.2e1_dp) + | ^ +Warning: 't422' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't420' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & - | ^ -note: 't42' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: + 4164 | - t249*t210*t872 + | ^ +Warning: 't419' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - 1544 | *t36*t38*t1396 - | ^ + 4234 | *(t435)*(t437)*(t976) + | ^ Warning: 't418' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:66: - - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & - | ^ -note: 't418' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - - 1456 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:60: - - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & - | ^ -note: 't417' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - - 1544 | *t36*t38*t1396 - | ^ -Warning: 't413' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:54: - - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & - | ^ -note: 't413' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1304:30: - - 1304 | t489 = t41*t135 - | ^ -Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:42: - - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & - | ^ -note: 't41' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: - - 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't408' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:37: - - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & - | ^ -note: 't408' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: - - 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't416' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't408' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't406' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4210:31: - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & + 4210 | t1101 = t125*t404*t129 | ^ -note: 't405' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: - - 1553 | t98*t1400 - | ^ Warning: 't404' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:25: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & - | ^ -note: 't404' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: + 4234 | *(t435)*(t437)*(t976) + | ^ +Warning: 't403' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4341:47: - 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) - | ^ + 4341 | + t1079*t210*t1080*t316) + | ^ Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:19: - - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & - | ^ -note: 't401' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) - | ^ + 4234 | *(t435)*(t437)*(t976) + | ^ Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1049:13: - - 1049 | t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, t435, & - | ^ -note: 't400' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1152:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't399' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't397' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4205:30: - 1152 | t128 = t40*t127 + 4205 | t1065 = t96*t115*t391 | ^ -Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:92: - - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't40' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - - 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) - | ^ -Warning: 't397' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:87: - - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't397' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - - 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't393' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:81: - - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't393' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1158:29: - - 1158 | t137 = t39*t94 - | ^ -Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:75: - - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't39' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - - 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) - | ^ -Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:70: - - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't384' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - - 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) - | ^ -Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:64: - - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't383' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - - 1442 | *t244*ndrho/t657/t7*t669) - | ^ -Warning: 't382' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:58: - - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't382' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1257:68: +Warning: 't391' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: - 1257 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 - | ^ -Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:52: + 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) + | ^ +Warning: 't388' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4112:23: - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't38' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: + 4112 | t713 = t4*t381 + | ^ +Warning: 't381' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: - 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) - | ^ -Warning: 't377' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:47: + 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 + | ^ +Warning: 't380' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't377' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: + 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) + | ^ +Warning: 't379' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: Warning: 't377' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: - 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:41: + 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 + | ^ +Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't372' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1286:30: + 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) + | ^ +Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: - 1286 | t435 = t37*t196 - | ^ -Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:35: + 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 + | ^ +Warning: 't374' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4330:26: - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't37' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: + 4330 | t1480 = t589*t373 + | ^ +Warning: 't373' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: - 1553 | t98*t1400 - | ^ -Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:30: + 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 + | ^ +Warning: 't370' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't368' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: + 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) + | ^ +Warning: 't369' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: - 1553 | t98*t1400 - | ^ + 4356 | t419*t77*t871)/0.2e1_dp) + | ^ Warning: 't365' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:24: - - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't365' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: - - 1553 | t98*t1400 - | ^ -Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:18: - - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't36' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1363:30: - - 1363 | t601 = t27*t358 - | ^ -Warning: 't358' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1048:13: - - 1048 | t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, t40, & - | ^ -note: 't358' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: - - 1421 | + 0.3333333334e0_dp*t36*t38*t838 - | ^ -Warning: 't354' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:96: - - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't354' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - - 1477 | t41*t328*t466 - | ^ -Warning: 't351' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:90: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't351' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: + 4234 | *(t435)*(t437)*(t976) + | ^ +Warning: 't364' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4187:24: - 1477 | t41*t328*t466 - | ^ -Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:84: + 4187 | t967 = t361*t82 + | ^ +Warning: 't361' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't347' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1406:40: + 4356 | t419*t77*t871)/0.2e1_dp) + | ^ +Warning: 't359' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't352' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: - 1406 | REAL(t46, KIND=dp) - | ^ -Warning: 't346' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:78: + 4429 | *t461*t320) - (2._dp*t91*t344*t875) + | ^ +Warning: 't345' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4248:21: - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't346' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: + 4248 | *t58 + | ^ +Warning: 't344' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: - 1477 | t41*t328*t466 - | ^ -Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:72: + 4429 | *t461*t320) - (2._dp*t91*t344*t875) + | ^ +Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't343' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: + 4356 | t419*t77*t871)/0.2e1_dp) + | ^ +Warning: 't341' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: - 1477 | t41*t328*t466 - | ^ + 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) + | ^ Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:61: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4186:132: - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't339' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1470:68: + 4186 | *t759*t68 - 2._dp*t335*t278 + 2._dp*t85*t769 - t85*t804)) + | ^ +Warning: 't338' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: - 1470 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 - | ^ + 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) + | ^ Warning: 't335' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:55: - - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't335' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1406:40: - - 1406 | REAL(t46, KIND=dp) - | ^ -Warning: 't330' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:49: - - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't330' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: Warning: 't332' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: Warning: 't329' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4186:132: - 1477 | t41*t328*t466 - | ^ + 4186 | *t759*t68 - 2._dp*t335*t278 + 2._dp*t85*t769 - t85*t804)) + | ^ Warning: 't328' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:43: - - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't328' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - - 1477 | t41*t328*t466 - | ^ -Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:37: - - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't326' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: - 1421 | + 0.3333333334e0_dp*t36*t38*t838 - | ^ + 4429 | *t461*t320) - (2._dp*t91*t344*t875) + | ^ Warning: 't325' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:31: - - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't325' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1463:38: - - 1463 | *t128*t323*t172 - | ^ -Warning: 't323' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:25: - - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't323' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4430:97: - 1421 | + 0.3333333334e0_dp*t36*t38*t838 - | ^ -Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:19: + 4430 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t322*t696 - t80*(t1652 + t1860)*Clda)*sx + | ^ +Warning: 't322' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't321' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: + 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) + | ^ +Warning: 't320' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4177:26: - 1421 | + 0.3333333334e0_dp*t36*t38*t838 - | ^ -Warning: 't319' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1047:13: + 4177 | *t210*t917 + | ^ +Warning: 't318' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4432:111: - 1047 | t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, t354, & - | ^ -note: 't319' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: + 4432 | t68 - 2._dp*t561*t317 + 2._dp*t85*t900 - t85*t917) + | ^ +Warning: 't317' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4341:47: - 1421 | + 0.3333333334e0_dp*t36*t38*t838 - | ^ + 4341 | + t1079*t210*t1080*t316) + | ^ Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:97: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't316' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: - 1544 | *t36*t38*t1396 - | ^ + 4157 | (48._dp*t313*t274) + | ^ Warning: 't313' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:91: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't313' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1528:63: - - 1528 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't312' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:85: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't312' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1226:31: - - 1226 | *t30*t281 - | ^ -Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:73: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't31' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1485:76: - - 1485 | + t1136) - | ^ -Warning: 't304' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:68: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't304' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1144:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: 't309' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: 't308' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: 't305' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: 't304' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4177:26: - 1144 | t109 + 4177 | *t210*t917 | ^ -Warning: 't30' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:62: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't30' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1229:28: +Warning: 't302' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: - 1229 | t293 = t3*t55 - | ^ -Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:57: + 4164 | - t249*t210*t872 + | ^ +Warning: 't301' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4342:26: - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't3' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: + 4342 | t1562 = t300*t251 + | ^ +Warning: 't300' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: - 1544 | *t36*t38*t1396 - | ^ + 4151 | - 0.16e2_dp/0.3e1_dp*t296*t235*t238 - (16._dp*t297*t242) + | ^ Warning: 't297' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:53: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't297' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - - 1544 | *t36*t38*t1396 - | ^ -Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:47: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't293' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1194:35: - - 1194 | t211 = rho*t29*omega - | ^ -Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:41: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't29' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - - 1544 | *t36*t38*t1396 - | ^ -Warning: 't289' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:36: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't289' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - - 1456 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't285' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:30: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't285' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1421:54: - - 1421 | + 0.3333333334e0_dp*t36*t38*t838 - | ^ -Warning: 't284' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:24: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't284' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - - 1456 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't281' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:18: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't281' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1141:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: Warning: 't296' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: - 1141 | t105 = t28*t104 + 4173 | a5*t21*t54*t65 | ^ -Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1046:12: - - 1046 | t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, t316, & - | ^ -note: 't28' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - - 1544 | *t36*t38*t1396 - | ^ -Warning: 't271' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:95: - - 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & - | ^ -note: 't271' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't270' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:89: - - 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & - | ^ -note: 't270' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - - 1456 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't265' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:78: - - 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & - | ^ -note: 't265' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - - 1456 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't264' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:72: +Warning: 't295' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: - 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & + 4151 | - 0.16e2_dp/0.3e1_dp*t296*t235*t238 - (16._dp*t297*t242) | ^ -note: 't264' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: - - 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 - | ^ -Warning: 't259' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:61: - - 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & - | ^ -note: 't259' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: - - 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:55: - - 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & - | ^ -note: 't258' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - - 1442 | *t244*ndrho/t657/t7*t669) - | ^ -Warning: 't255' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:49: - - 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & - | ^ -note: 't255' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - - 1442 | *t244*ndrho/t657/t7*t669) - | ^ -Warning: 't254' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:43: - - 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & - | ^ -note: 't254' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - - 1442 | *t244*ndrho/t657/t7*t669) - | ^ -Warning: 't251' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:37: - - 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & - | ^ -note: 't251' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - - 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:31: - - 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & - | ^ -note: 't250' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - - 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) - | ^ -Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:25: - - 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & - | ^ -note: 't245' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - - 1442 | *t244*ndrho/t657/t7*t669) - | ^ -Warning: 't244' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:19: - - 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & - | ^ -note: 't244' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - - 1442 | *t244*ndrho/t657/t7*t669) - | ^ -Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1045:13: - - 1045 | t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, t271, & - | ^ -note: 't241' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: - - 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 - | ^ -Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:96: - - 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & - | ^ -note: 't24' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - - 1442 | *t244*ndrho/t657/t7*t669) - | ^ -Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:91: - - 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & - | ^ -note: 't237' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: +Warning: 't292' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: Warning: 't291' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: - 1442 | *t244*ndrho/t657/t7*t669) - | ^ -Warning: 't233' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:85: + 4164 | - t249*t210*t872 + | ^ +Warning: 't288' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4153:24: - 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & - | ^ -note: 't233' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: + 4153 | t849 = t287*t18 + | ^ +Warning: 't287' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: - 1442 | *t244*ndrho/t657/t7*t669) - | ^ -Warning: 't232' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:79: + 4376 | *t320 + | ^ +Warning: 't285' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: - 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & - | ^ -note: 't232' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: + 4164 | - t249*t210*t872 + | ^ +Warning: 't279' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: - 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't230' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:67: + 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) + | ^ +Warning: 't278' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & - | ^ -note: 't230' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1140:34: + 4234 | *(t435)*(t437)*(t976) + | ^ +Warning: 't277' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: - 1140 | t104 = 0.1e1_dp/t23 + 4157 | (48._dp*t313*t274) | ^ -Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:61: - - 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & - | ^ -note: 't23' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - - 1442 | *t244*ndrho/t657/t7*t669) - | ^ -Warning: 't226' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:56: - - 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & - | ^ -note: 't226' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1509:77: - - 1509 | *t397 - 0.2400000000e2_dp*t245/t657/rho*t669) - | ^ -Warning: 't225' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:50: - - 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & - | ^ -note: 't225' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1442:55: - - 1442 | *t244*ndrho/t657/t7*t669) - | ^ -Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:44: +Warning: 't274' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: 't268' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: - 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & + 4141 | t63) | ^ -note: 't222' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1368:30: - - 1368 | t628 = t221*t76 - | ^ -Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:38: - - 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & - | ^ -note: 't221' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1119:34: +Warning: 't266' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: - 1119 | t68 = rho*t22*omega + 4157 | (48._dp*t313*t274) | ^ -Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:32: - - 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & - | ^ -note: 't22' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1382:63: - - 1382 | /t69*t669) - | ^ -Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1044:27: - - 1044 | REAL(kind=dp) :: t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, t24, & - | ^ -note: 't219' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: - - 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 - | ^ -Warning: 't216' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:70: - - 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 - | ^ -note: 't216' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1427:67: +Warning: 't262' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: - 1427 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 - | ^ -Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:64: + 4141 | t63) + | ^ +Warning: 't261' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: Warning: 't260' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: - 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 - | ^ -note: 't213' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: + 4157 | (48._dp*t313*t274) + | ^ +Warning: 't259' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: - 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:58: + 4376 | *t320 + | ^ +Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: - 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 - | ^ -note: 't212' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1494:76: + 4141 | t63) + | ^ +Warning: 't252' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4342:26: - 1494 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't211' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:52: + 4342 | t1562 = t300*t251 + | ^ +Warning: 't251' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4132:33: - 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 - | ^ -note: 't211' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1232:30: + 4132 | t767 = 0.1e1_dp/t250/t67 + | ^ +Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4143:30: - 1232 | t311 = t126*t21 + 4143 | t806 = t249*t210*t804 | ^ -Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:46: - - 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 - | ^ -note: 't21' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: +Warning: 't249' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: - 1553 | t98*t1400 + 4164 | - t249*t210*t872 | ^ -Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:41: - - 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 - | ^ -note: 't207' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1263:30: - - 1263 | t365 = t27*t200 - | ^ -Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:35: +Warning: 't247' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4117:35: - 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 + 4117 | t724 = 4._dp*t11*t218*t246 | ^ -note: 't200' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1346:29: - - 1346 | t576 = t2*t501 - | ^ -Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:29: +Warning: 't246' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4214:26: - 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 - | ^ -note: 't2' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1313:70: + 4214 | t1121 = t245*t251 + | ^ +Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: - 1313 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 - | ^ -Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:25: + 4157 | (48._dp*t313*t274) + | ^ +Warning: 't242' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: 't238' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4122:25: - 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 + 4122 | t748 = t237*t231 | ^ -note: 't196' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - - 1477 | t41*t328*t466 - | ^ -Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:19: - - 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 - | ^ -note: 't190' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1043:13: - - 1043 | t186, t190, t196, t2, t200, t207, t21, t211, t212, t213, t216 - | ^ -note: 't186' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:96: - - 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & - | ^ -note: 't185' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1176:59: - - 1176 | t172 = 0.40e1_dp*t11*t18 - 0.20e1_dp*t6*t169 - | ^ -Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:90: - - 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & - | ^ -note: 't18' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:85: - - 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & - | ^ -note: 't177' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1318:79: - - 1318 | *t24*t98*t496)*sx - | ^ -Warning: 't173' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:73: - - 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & - | ^ -note: 't173' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1355:35: - - 1355 | *t36*t38*t586 - | ^ -Warning: 't172' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:67: +Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: - 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & - | ^ -note: 't172' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1122:28: + 4128 | *t25*t756) + | ^ +Warning: 't236' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: - 1122 | t72 = t71*t17 - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:61: + 4157 | (48._dp*t313*t274) + | ^ +Warning: 't235' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4248:21: - 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & - | ^ -note: 't17' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1331:41: + 4248 | *t58 + | ^ +Warning: 't234' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: - 1331 | - 0.20e1_dp*t6*t526 - | ^ -Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:56: + 4151 | - 0.16e2_dp/0.3e1_dp*t296*t235*t238 - (16._dp*t297*t242) + | ^ +Warning: 't228' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: - 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & - | ^ -note: 't169' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1266:31: + 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) + | ^ +Warning: 't227' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: - 1266 | t377 = t225*t168 - | ^ -Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:50: + 4151 | - 0.16e2_dp/0.3e1_dp*t296*t235*t238 - (16._dp*t297*t242) + | ^ +Warning: 't224' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: - 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & - | ^ -note: 't168' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1203:38: + 4128 | *t25*t756) + | ^ +Warning: 't223' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - 1203 | t230 = 0.1e1_dp/t75/t16 + 4234 | *(t435)*(t437)*(t976) | ^ -Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:44: - - 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & - | ^ -note: 't16' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1193:30: - - 1193 | t207 = t27*t155 - | ^ -Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:32: +Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: - 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & + 4164 | - t249*t210*t872 | ^ -note: 't155' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1257:68: - - 1257 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 - | ^ -Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:26: - - 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & - | ^ -note: 't151' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1308:82: - - 1308 | - 0.5555555558e-1_dp*t146*t486 - 0.5000000001e0_dp*t489*t466 - | ^ -Warning: 't148' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1042:20: - - 1042 | t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, t185, & - | ^ -note: 't148' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - - 1477 | t41*t328*t466 - | ^ -Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:93: - - 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & - | ^ -note: 't147' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1477:36: - - 1477 | t41*t328*t466 - | ^ -Warning: 't146' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:80: - - 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & - | ^ -note: 't146' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1308:82: - - 1308 | - 0.5555555558e-1_dp*t146*t486 - 0.5000000001e0_dp*t489*t466 - | ^ -Warning: 't143' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:60: - - 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & - | ^ -note: 't143' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1245:35: - - 1245 | t343 = t141*t135*t46 - | ^ -Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:47: - - 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & - | ^ -note: 't141' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1580:74: - - 1580 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1041:20: - - 1041 | t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, t147, & - | ^ -note: 't140' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1406:40: - - 1406 | REAL(t46, KIND=dp) - | ^ -Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:89: - - 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & - | ^ -note: 't137' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1470:68: - - 1470 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 - | ^ -Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:83: - - 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & - | ^ -note: 't136' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1304:30: - - 1304 | t489 = t41*t135 - | ^ -Warning: 't135' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:77: - - 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & - | ^ -note: 't135' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1219:69: - - 1219 | t264 = 0.9000000000e1_dp*t130 - 0.6000000000e1_dp*t133 - | ^ -Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:50: - - 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & - | ^ -note: 't133' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1514:57: - - 1514 | + 0.5999999999e1_dp*t128*t132*t529 - | ^ -Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:44: - - 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & - | ^ -note: 't132' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1219:69: - - 1219 | t264 = 0.9000000000e1_dp*t130 - 0.6000000000e1_dp*t133 - | ^ -Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:38: +Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & + 4234 | *(t435)*(t437)*(t976) | ^ -note: 't130' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1237:35: - - 1237 | t321 = t128*t43*t258 - | ^ -Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:25: - - 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & - | ^ -note: 't128' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1299:30: - - 1299 | t473 = t94*t127 - | ^ -Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:19: - - 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & - | ^ -note: 't127' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1232:30: - - 1232 | t311 = t126*t21 - | ^ -Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1040:13: - - 1040 | t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, t1370, & - | ^ -note: 't126' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1313:70: - - 1313 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 - | ^ -Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:85: - - 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & - | ^ -note: 't122' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1174:67: - - 1174 | t168 = 0.60e1_dp*beta*t3*t12 + 0.60e1_dp*t11*t10*t86 - | ^ -Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:79: - - 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & - | ^ -note: 't12' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1257:68: - - 1257 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 - | ^ -Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:74: - - 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & - | ^ -note: 't118' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: +Warning: 't218' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: - 1544 | *t36*t38*t1396 - | ^ -Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:61: + 4322 | *t199*t285 + t550*t285)) + | ^ +Warning: 't217' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4120:34: - 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & - | ^ -note: 't117' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1553:32: + 4120 | t743 = t56*r3*t58*t5*t216 + | ^ +Warning: 't216' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: - 1553 | t98*t1400 + 4164 | - t249*t210*t872 | ^ -Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1039:41: - - 1039 | t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, t1220, & - | ^ -note: 't116' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1544:37: - - 1544 | *t36*t38*t1396 - | ^ -Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:89: - - 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & - | ^ -note: 't113' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1456:57: - - 1456 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:83: - - 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & - | ^ -note: 't112' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1562:99: - - 1562 | *t250*ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:70: - - 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & - | ^ -note: 't11' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1284:66: - - 1284 | *t31*t404 - 0.5000000000e0_dp*t105*t109*t172 - | ^ -Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:58: - - 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & - | ^ -note: 't109' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1355:35: - - 1355 | *t36*t38*t586 - | ^ -Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:45: - - 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & - | ^ -note: 't105' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1364:36: +Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4135:36: - 1364 | t605 = rho*t104*omega + 4135 | t772 = 2._dp*t249*t210*t769 | ^ -Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:32: +Warning: 't210' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: - 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & + 4164 | - t249*t210*t872 | ^ -note: 't104' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1355:35: - - 1355 | *t36*t38*t586 - | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1038:26: - - 1038 | t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, t1136, & - | ^ -note: 't103' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1174:67: - - 1174 | t168 = 0.60e1_dp*beta*t3*t12 + 0.60e1_dp*t11*t10*t86 - | ^ -Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1037:77: - - 1037 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, ndrho, rho, t1, t10, t100, t1002, t1009, & - | ^ -note: 't10' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1186:69: - - 1186 | t117*t118*t172 + 0.3333333334e0_dp*t36*t38*t196 - | ^ -Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:1037:72: - - 1037 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, ndrho, rho, t1, t10, t100, t1002, t1009, & - | ^ -note: 't1' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: - - 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 - | ^ -Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:287:26: +Warning: 't209' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4147:25: - 287 | REAL(kind=dp) :: t98, t99, xx - | ^ -note: 't98' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:492:94: + 4147 | t813 = t287*t208 + | ^ +Warning: 't208' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4419:65: - 492 | *t68*t259 - 0.2222222224e0_dp*t24*t98*t358)*sx - | ^ + 4419 | *t1739 + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t1712) + | ^ Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:67: - - 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 - | ^ -note: 't95' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:544:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: - 544 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 - | ^ + 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) + | ^ Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:62: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: - 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 - | ^ -note: 't94' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:507:72: + 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) + | ^ +Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - 507 | *t11*t91 + 0.40e1_dp*t382*t384 - 0.20e1_dp*t6*t401 - | ^ -Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:51: + 4234 | *(t435)*(t437)*(t976) + | ^ +Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: - 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 - | ^ -note: 't91' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:433:30: + 4322 | *t199*t285 + t550*t285)) + | ^ +Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4261:30: - 433 | t226 = t225*t90 + 4261 | t1240 = t180*t90*t149 | ^ Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:46: - - 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 - | ^ -note: 't90' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:504:55: - - 504 | t87 + 0.8000000000e1_dp*t393*t397 - | ^ -Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:35: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4136:32: - 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 - | ^ -note: 't87' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:559:66: + 4136 | t781 = 0.1e1_dp/t9/t743 + | ^ +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4045:41: - 559 | t525 = 0.120e2_dp*t508*t86 - 0.60e1_dp*t6*t521*t250 - | ^ -Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:286:18: + 4045 | t567 = 2._dp*t288*t88 + t11*t565 + | ^ +Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4186:132: - 286 | t857, t86, t860, t867, t87, t880, t90, t91, t933, t94, t95, t961 - | ^ -note: 't86' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:606:39: + 4186 | *t759*t68 - 2._dp*t335*t278 + 2._dp*t85*t769 - t85*t804)) + | ^ +Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4432:111: - 606 | t669 = 0.1e1_dp/t85/t667 - | ^ + 4432 | t68 - 2._dp*t561*t317 + 2._dp*t85*t900 - t85*t917) + | ^ Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:95: - - 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & - | ^ -note: 't85' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:605:28: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: - 605 | t667 = t84**2 - | ^ + 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) + | ^ Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:78: - - 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & - | ^ -note: 't84' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:390:31: - - 390 | t140 = t8*my_rho - | ^ -Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:67: - - 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & - | ^ -note: 't8' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:624:67: - - 624 | *t128*t43*t677 - 0.2666666667e1_dp*t42*pi*t79 - | ^ -Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: - 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & - | ^ -note: 't79' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:446:30: + 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) + | ^ +Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3927:24: - 446 | t255 = t77*t254 - | ^ -Warning: 't77' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:46: + 3927 | t352 = t82*t325 + | ^ +Warning: 't82' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4495:71: - 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & - | ^ -note: 't77' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: + 4495 | e_ndrho_ndrho = e_ndrho_ndrho + (-t80*(t2013 + t2174)*Clda)*sx + | ^ +Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4121:27: - 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:35: + 4121 | t746 = t24/t8/t743 + | ^ +Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4179:22: - 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & - | ^ -note: 't76' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:601:28: + 4179 | t922 = t78**2 + | ^ +Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4310:23: - 601 | t639 = t75**2 - | ^ + 4310 | t1400 = t75**2 + | ^ Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:285:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4145:67: - 285 | t735, t739, t746, t75, t76, t769, t77, t79, t791, t793, t8, t838, t84, t842, t846, t85, & - | ^ -note: 't75' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:507:72: + 4145 | + t772 - t806 + 0.10e2_dp/0.9e1_dp*t73*t258*t56*t58 + | ^ +Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4181:64: - 507 | *t11*t91 + 0.40e1_dp*t382*t384 - 0.20e1_dp*t6*t401 - | ^ + 4181 | + t772 - t806 + 0.10e2_dp/0.9e1_dp*t72*t258*t231 + | ^ Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:90: - - 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & - | ^ -note: 't72' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - - 673 | *t244*my_ndrho/t657/t7*t669) - | ^ -Warning: 't71' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:79: - - 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & - | ^ -note: 't71' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:351:30: - - 351 | t69 = t7*my_rho - | ^ -Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:74: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3912:53: - 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & - | ^ -note: 't7' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:613:63: + 3912 | t320 = 2._dp*t288*t70 + t11*t302 - t249*t318 + | ^ +Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4116:34: - 613 | /t69*t669) - | ^ + 4116 | t721 = 6._dp*t11*t718*t69 + | ^ Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:70: - - 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & - | ^ -note: 't69' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4055:25: - 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ + 4055 | t595 = t68*ndrho + | ^ Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:59: - - 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & - | ^ -note: 't68' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - - 784 | t98*t1400 - | ^ -Warning: 't64' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:284:18: - - 284 | t639, t64, t640, t641, t657, t667, t669, t677, t68, t687, t69, t7, t71, t716, t72, t722, & - | ^ -note: 't64' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:403:74: - - 403 | 0.2222222224e0_dp*t24*t98*t155)*sx - | ^ -Warning: 't60' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:51: - - 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & - | ^ -note: 't60' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - - 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) - | ^ -Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:46: - - 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & - | ^ -note: 't6' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:729:31: - - 729 | t1153 = t27*t590 - | ^ -Warning: 't590' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:42: - - 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & - | ^ -note: 't590' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3875:22: - 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:36: + 3875 | t250 = t67**2 + | ^ +Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: - 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & - | ^ -note: 't59' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: + 4173 | a5*t21*t54*t65 + | ^ +Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: - 775 | *t36*t38*t1396 - | ^ -Warning: 't586' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:31: + 4141 | t63) + | ^ +Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3885:31: - 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & + 3885 | t274 = t60/t61/rho*t63 | ^ -note: 't586' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: - - 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't580' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:25: - - 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & - | ^ -note: 't580' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - - 775 | *t36*t38*t1396 - | ^ -Warning: 't576' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:19: - - 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & - | ^ -note: 't576' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't575' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:283:13: - - 283 | t575, t576, t580, t586, t59, t590, t6, t60, t601, t605, t606, t613, t624, t628, t632, & - | ^ -note: 't575' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - - 775 | *t36*t38*t1396 - | ^ -Warning: 't574' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:96: - - 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & - | ^ -note: 't574' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: - - 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't573' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:90: - - 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & - | ^ -note: 't573' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't572' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:84: - - 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & - | ^ -note: 't572' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't571' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:78: - - 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & - | ^ -note: 't571' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't570' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:72: - - 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & - | ^ -note: 't570' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - - 775 | *t36*t38*t1396 - | ^ -Warning: 't566' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:66: - - 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & - | ^ -note: 't566' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - - 775 | *t36*t38*t1396 - | ^ -Warning: 't562' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:60: - - 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & - | ^ -note: 't562' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:400:26: +Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: - 400 | t151 - | ^ + 4141 | t63) + | ^ Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:54: - - 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & - | ^ -note: 't55' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't539' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:49: - - 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & - | ^ -note: 't539' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't537' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:43: - - 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & - | ^ -note: 't537' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't536' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:37: - - 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & - | ^ -note: 't536' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - - 784 | t98*t1400 - | ^ -Warning: 't530' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:19: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: - 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & - | ^ -note: 't530' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:817:44: + 4173 | a5*t21*t54*t65 + | ^ +Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: - 817 | *sx + 4141 | t63) | ^ -Warning: 't529' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:282:13: - - 282 | t529, t530, t533, t534, t536, t537, t539, t55, t562, t566, t570, t571, t572, t573, t574, & - | ^ -note: 't529' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - - 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't526' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:93: - - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't526' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - - 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't525' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:87: - - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't525' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - - 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't521' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:81: - - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't521' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:415:59: - - 415 | *t52 - 0.5000000001e0_dp*t41*t172*t46 - | ^ -Warning: 't52' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:75: - - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't52' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:598:38: - - 598 | t624 = 0.1e1_dp/t8/t519 - | ^ -Warning: 't519' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:70: - - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't519' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - - 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't514' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:64: +Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4123:26: - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't514' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: + 4123 | t752 = t46*t31*t6 + | ^ +Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: - 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) - | ^ -Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:58: + 4322 | *t199*t285 + t550*t285)) + | ^ +Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't513' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:475:33: + 4141 | t63) + | ^ +Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4197:33: - 475 | t339 = t48*t10*t51 + 4197 | t1032 = t116*t251*t4*t44 | ^ -Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:52: +Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't51' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: + 4141 | t63) + | ^ +Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3908:26: - 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't508' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:47: + 3908 | t313 = a5*t38*t54 + | ^ +Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't508' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: + 4141 | t63) + | ^ +Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4215:25: - 784 | t98*t1400 - | ^ -Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:41: + 4215 | t1124 = t34*t767 + | ^ +Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't505' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: + 4173 | a5*t21*t54*t65 + | ^ +Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4124:28: - 784 | t98*t1400 - | ^ -Warning: 't502' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:35: + 4124 | t756 = t27*t266*t31 + | ^ +Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't502' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:817:44: + 4128 | *t25*t756) + | ^ +Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: - 817 | *sx + 4141 | t63) | ^ -Warning: 't501' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:29: - - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't501' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:613:63: +Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4124:28: - 613 | /t69*t669) - | ^ -Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:23: + 4124 | t756 = t27*t266*t31 + | ^ +Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't5' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:662:30: + 4128 | *t25*t756) + | ^ +Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: - 662 | t857 = t27*t496 + 4173 | a5*t21*t54*t65 | ^ -Warning: 't496' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:19: - - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't496' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:716:76: - - 716 | + t1136) - | ^ -Warning: 't492' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:281:13: - - 281 | t492, t496, t5, t501, t502, t505, t508, t51, t513, t514, t519, t52, t521, t525, t526, & - | ^ -note: 't492' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: - - 687 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:96: - - 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & - | ^ -note: 't49' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: +Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4324:64: - 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:91: + 4324 | - t80*(t1189 + t1408)*Clda)*sx + | ^ +Warning: 't206' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: - 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & - | ^ -note: 't489' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: + 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) + | ^ +Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: - 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't486' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:85: + 4461 | - (4._dp*t568*t570) + | ^ +Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: - 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & - | ^ -note: 't486' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: + 4322 | *t199*t285 + t550*t285)) + | ^ +Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: Warning: 't193' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: - 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't482' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:79: + 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) + | ^ +Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: - 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & - | ^ -note: 't482' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: + 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) + | ^ +Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: - 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:68: + 4322 | *t199*t285 + t550*t285)) + | ^ +Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: - 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & - | ^ -note: 't479' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:701:68: + 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) + | ^ +Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4289:26: - 701 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 - | ^ -Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:62: + 4289 | t1331 = t166*t181 + | ^ +Warning: 't181' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: - 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & - | ^ -note: 't478' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: + 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) + | ^ +Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4406:26: - 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't473' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:56: + 4406 | t1796 = t176*t177 + | ^ +Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4248:21: - 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & - | ^ -note: 't473' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:701:68: + 4248 | *t58 + | ^ +Warning: 't174' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: - 701 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 + 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) | ^ -Warning: 't470' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:50: +Warning: 't170' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: - 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & - | ^ -note: 't470' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:637:40: + 4128 | *t25*t756) + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4264:40: - 637 | REAL(t46, KIND=dp) + 4264 | t1250 = 0.1e1_dp/t169/t156/t155 | ^ -Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:44: - - 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & - | ^ -note: 't47' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: +Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: - 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't467' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:39: + 4429 | *t461*t320) - (2._dp*t91*t344*t875) + | ^ +Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4393:26: - 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & - | ^ -note: 't467' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: + 4393 | t1737 = t166*t167 + | ^ +Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4404:124: - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't466' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:33: + 4404 | *t471*t875)/0.2e1_dp + (10._dp*t1685*t1762) + | ^ +Warning: 't163' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4286:35: - 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & - | ^ -note: 't466' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: + 4286 | t1315 = 0.1e1_dp/t162/t155 + | ^ +Warning: 't162' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: - 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't465' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:280:27: + 4128 | *t25*t756) + | ^ +Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: - 280 | REAL(kind=dp) :: t465, t466, t467, t47, t470, t473, t478, t479, t48, t482, t486, t489, t49, & - | ^ -note: 't465' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: + 4376 | *t320 + | ^ +Warning: 't159' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4254:41: - 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't464' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:71: + 4254 | t1213 = 0.1e1_dp/t158/t1210/t155 + | ^ +Warning: 't158' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3985:34: - 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 - | ^ -note: 't464' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: + 3985 | t456 = 0.1e1_dp/t158/t157 + | ^ +Warning: 't157' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4396:32: - 708 | t41*t328*t466 - | ^ -Warning: 't463' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:65: + 4396 | t1753 = t456*t156*t1687 + | ^ +Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4382:32: - 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 - | ^ -note: 't463' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: + 4382 | t1692 = t483*t155*t1687 + | ^ +Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4394:32: - 708 | t41*t328*t466 - | ^ -Warning: 't462' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:59: + 4394 | t1739 = t483*t154*t1687 + | ^ +Warning: 't154' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4379:26: - 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 - | ^ -note: 't462' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: + 4379 | t1685 = t151*t152 + | ^ +Warning: 't152' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - 687 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't460' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:53: + 4234 | *(t435)*(t437)*(t976) + | ^ +Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: - 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 - | ^ -note: 't460' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:415:59: + 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) + | ^ +Warning: 't149' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4281:26: - 415 | *t52 - 0.5000000001e0_dp*t41*t172*t46 - | ^ -Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:47: + 4281 | t1295 = t148*t968 + | ^ +Warning: 't148' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4250:31: - 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 - | ^ -note: 't46' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: + 4250 | t1202 = t176*t147*t149 + | ^ +Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: - 687 | - 0.1111111111e0_dp*t117*t293*t404 + 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ -Warning: 't457' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:42: - - 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 - | ^ -note: 't457' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: +Warning: 't145' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3974:25: - 687 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't455' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:36: + 3974 | t435 = t141*t142 + | ^ +Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: - 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 - | ^ -note: 't455' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:745:57: + 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) + | ^ +Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: - 745 | + 0.5999999999e1_dp*t128*t132*t529 + 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ -Warning: 't452' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:30: - - 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 - | ^ -note: 't452' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: - - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't451' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:24: - - 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 - | ^ -note: 't451' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:370:49: - - 370 | t103 = EXP(-0.9000000000e1_dp*t44) - | ^ -Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:18: - - 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 - | ^ -note: 't44' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - - 775 | *t36*t38*t1396 - | ^ -Warning: 't435' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:279:13: - - 279 | t435, t44, t451, t452, t455, t457, t46, t460, t462, t463, t464 - | ^ -note: 't435' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:384:34: - - 384 | t130 = t128*t43*t94 - | ^ -Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:93: +Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & - | ^ -note: 't43' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: + 4356 | t419*t77*t871)/0.2e1_dp) + | ^ +Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - 775 | *t36*t38*t1396 - | ^ -Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:88: + 4234 | *(t435)*(t437)*(t976) + | ^ +Warning: 't131' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & - | ^ -note: 't429' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: + 4356 | t419*t77*t871)/0.2e1_dp) + | ^ +Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: - 687 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:82: + 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) + | ^ +Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & - | ^ -note: 't428' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:386:30: + 4234 | *(t435)*(t437)*(t976) + | ^ +Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3961:30: - 386 | t133 = t42*t132 + 3961 | t416 = t125*t126*t128 | ^ -Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:76: - - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & - | ^ -note: 't42' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - - 775 | *t36*t38*t1396 - | ^ -Warning: 't418' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:71: +Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4206:25: - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & - | ^ -note: 't418' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: + 4206 | t1068 = t96*t124 + | ^ +Warning: 't124' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: - 687 | - 0.1111111111e0_dp*t117*t293*t404 + 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) | ^ -Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:65: - - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & - | ^ -note: 't417' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - - 775 | *t36*t38*t1396 - | ^ -Warning: 't413' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:59: +Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & - | ^ -note: 't413' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:535:30: + 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) + | ^ +Warning: 't120' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3851:23: - 535 | t489 = t41*t135 - | ^ -Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:47: + 3851 | t216 = t12*rho + | ^ +Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4341:47: - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & + 4341 | + t1079*t210*t1080*t316) | ^ -note: 't41' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: - - 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't408' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:42: - - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & - | ^ -note: 't408' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: - - 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:36: - - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & - | ^ -note: 't405' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - - 784 | t98*t1400 - | ^ -Warning: 't404' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:30: - - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & - | ^ -note: 't404' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - - 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) - | ^ -Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:24: - - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & - | ^ -note: 't401' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - - 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) - | ^ -Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:18: - - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & - | ^ -note: 't400' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:383:30: - - 383 | t128 = t40*t127 - | ^ -Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:278:12: - - 278 | t40, t400, t401, t404, t405, t408, t41, t412, t413, t417, t418, t42, t428, t429, t43, & - | ^ -note: 't40' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - - 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) - | ^ -Warning: 't397' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:93: - - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't397' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - - 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't393' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:87: - - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't393' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:389:29: - - 389 | t137 = t39*t94 - | ^ -Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:81: - - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't39' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - - 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) - | ^ -Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:76: - - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't384' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - - 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) - | ^ -Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:70: - - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't383' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - - 673 | *t244*my_ndrho/t657/t7*t669) - | ^ -Warning: 't382' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:64: - - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't382' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:488:68: - - 488 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 - | ^ -Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:58: - - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't38' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - - 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) - | ^ -Warning: 't377' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:53: - - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't377' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: +Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: - 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:47: + 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 + | ^ +Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't372' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:517:30: + 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) + | ^ +Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3931:30: - 517 | t435 = t37*t196 + 3931 | t364 = t109/t110/t361 | ^ -Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:41: - - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't37' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: - - 784 | t98*t1400 - | ^ -Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:36: - - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't368' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: +Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4186:132: - 784 | t98*t1400 - | ^ -Warning: 't365' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:30: + 4186 | *t759*t68 - 2._dp*t335*t278 + 2._dp*t85*t769 - t85*t804)) + | ^ +Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't365' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: + 4234 | *(t435)*(t437)*(t976) + | ^ +Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: - 784 | t98*t1400 - | ^ -Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:24: + 4128 | *t25*t756) + | ^ +Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3898:24: - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & + 3898 | t295 = t1*ndrho | ^ -note: 't36' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:594:30: - - 594 | t601 = t27*t358 - | ^ -Warning: 't358' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:19: - - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't358' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: - - 652 | + 0.3333333334e0_dp*t36*t38*t838 - | ^ -Warning: 't354' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:277:13: - - 277 | t354, t358, t36, t365, t368, t37, t372, t377, t38, t382, t383, t384, t39, t393, t397, & - | ^ -note: 't354' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: - - 708 | t41*t328*t466 - | ^ -Warning: 't351' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:96: - - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & - | ^ -note: 't351' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: - - 708 | t41*t328*t466 - | ^ -Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:90: - - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & - | ^ -note: 't347' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:637:40: - - 637 | REAL(t46, KIND=dp) - | ^ -Warning: 't346' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:84: +Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3535:89: - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & - | ^ -note: 't346' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: + 3535 | t2274)*Clda)*sx + | ^ +Warning: 't920' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 708 | t41*t328*t466 - | ^ -Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:78: + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) + | ^ +Warning: 't917' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: Warning: 't903' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & - | ^ -note: 't343' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: + 3476 | - t852*t519 + f12*t2053*t94 + | ^ +Warning: 't886' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: - 708 | t41*t328*t466 - | ^ -Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:67: + 3453 | *t407) + | ^ +Warning: 't875' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & - | ^ -note: 't339' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:701:68: + 3533 | - (5._dp*t1726*t506*t6*t407) + | ^ +Warning: 't860' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: - 701 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 - | ^ -Warning: 't335' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:61: + 3476 | - t852*t519 + f12*t2053*t94 + | ^ +Warning: 't852' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & - | ^ -note: 't335' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:637:40: + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) + | ^ +Warning: 't839' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: Warning: 't833' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 637 | REAL(t46, KIND=dp) - | ^ -Warning: 't330' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:55: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't823' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: Warning: 't822' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & - | ^ -note: 't330' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: + 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 + | ^ +Warning: 't816' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: Warning: 't813' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: - 708 | t41*t328*t466 - | ^ -Warning: 't328' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:49: + 3476 | - t852*t519 + f12*t2053*t94 + | ^ +Warning: 't809' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & - | ^ -note: 't328' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: + 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) + | ^ +Warning: 't805' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: Warning: 't802' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: Warning: 't796' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: Warning: 't793' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: - 708 | t41*t328*t466 - | ^ -Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:43: + 3533 | - (5._dp*t1726*t506*t6*t407) + | ^ +Warning: 't788' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & + 3595 | /0.4e1_dp*t603*t1469*t2473 | ^ -note: 't326' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: +Warning: 't784' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3498:27: - 652 | + 0.3333333334e0_dp*t36*t38*t838 - | ^ -Warning: 't325' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:37: + 3498 | t2136 = t1332*t783 + | ^ +Warning: 't783' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & - | ^ -note: 't325' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:694:38: + 3595 | /0.4e1_dp*t603*t1469*t2473 + | ^ +Warning: 't781' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: - 694 | *t128*t323*t172 - | ^ -Warning: 't323' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:31: + 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) + | ^ +Warning: 't770' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3478:27: - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & - | ^ -note: 't323' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: + 3478 | t2066 = t1262*t769 + | ^ +Warning: 't769' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: - 652 | + 0.3333333334e0_dp*t36*t38*t838 - | ^ -Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:25: + 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) + | ^ +Warning: 't767' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & - | ^ -note: 't321' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: + 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 + | ^ +Warning: 't761' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3477:26: - 652 | + 0.3333333334e0_dp*t36*t38*t838 - | ^ -Warning: 't319' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:19: + 3477 | t2060 = t759*t513 + | ^ +Warning: 't759' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3507:26: - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & - | ^ -note: 't319' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: + 3507 | t2180 = t136*t758 + | ^ +Warning: 't758' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3567:93: - 652 | + 0.3333333334e0_dp*t36*t38*t838 - | ^ -Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:276:13: + 3567 | t3*t19 + 12._dp*g3*t1*t24*t32) + | ^ +Warning: 't756' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: - 276 | t316, t319, t321, t323, t325, t326, t328, t330, t335, t339, t34, t343, t346, t347, t351, & - | ^ -note: 't316' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: + 3459 | - (16._dp*t752*t331)) + | ^ +Warning: 't755' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't752' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't751' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't748' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't747' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: - 775 | *t36*t38*t1396 - | ^ -Warning: 't313' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:97: + 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 + | ^ +Warning: 't742' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: Warning: 't740' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3515:26: - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & - | ^ -note: 't313' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:759:63: + 3515 | t2211 = t140*t739 + | ^ +Warning: 't739' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: - 759 | t462*t466 - 0.5000000001e0_dp*t489*t1345 - | ^ -Warning: 't312' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:91: + 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) + | ^ +Warning: 't737' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & - | ^ -note: 't312' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:457:31: + 3471 | t404 - t733*t365 + 2._dp*t85*t1073 - t85*t1090) + | ^ +Warning: 't736' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: Warning: 't733' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3411:85: - 457 | *t30*t281 - | ^ -Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:79: + 3411 | t727 - t80*(t1392 + t1517 + t1577 + t1742)*Clda)*sx + | ^ +Warning: 't727' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & - | ^ -note: 't31' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:716:76: + 3364 | *t58 + | ^ +Warning: 't723' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 716 | + t1136) - | ^ -Warning: 't304' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:74: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't714' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & - | ^ -note: 't304' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:375:26: + 3409 | *t234*t1737*t452) + | ^ +Warning: 't710' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3385:26: - 375 | t109 + 3385 | t1671 = t709*t160 | ^ -Warning: 't30' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:68: - - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & - | ^ -note: 't30' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:460:28: - - 460 | t293 = t3*t55 - | ^ -Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:63: - - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & - | ^ -note: 't3' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: +Warning: 't709' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: - 775 | *t36*t38*t1396 - | ^ -Warning: 't297' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:59: + 3364 | *t58 + | ^ +Warning: 't705' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & + 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 | ^ -note: 't297' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - - 775 | *t36*t38*t1396 - | ^ -Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:53: +Warning: 't702' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ -note: 't293' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:425:38: - - 425 | t211 = my_rho*t29*omega - | ^ -Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:47: - - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & - | ^ -note: 't29' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: - - 775 | *t36*t38*t1396 - | ^ -Warning: 't289' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:42: - - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & - | ^ -note: 't289' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: - - 687 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't285' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:36: - - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & - | ^ -note: 't285' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:652:54: - - 652 | + 0.3333333334e0_dp*t36*t38*t838 - | ^ -Warning: 't284' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:30: - - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & - | ^ -note: 't284' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: +Warning: 't699' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: - 687 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't281' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:24: + 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 + | ^ +Warning: 't697' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: Warning: 't695' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & - | ^ -note: 't281' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:372:30: + 3476 | - t852*t519 + f12*t2053*t94 + | ^ +Warning: 't692' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 372 | t105 = t28*t104 - | ^ -Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:18: + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) + | ^ +Warning: 't689' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & - | ^ -note: 't28' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: + 3409 | *t234*t1737*t452) + | ^ +Warning: 't687' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: - 775 | *t36*t38*t1396 - | ^ -Warning: 't271' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:275:13: + 3364 | *t58 + | ^ +Warning: 't681' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: Warning: 't679' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: - 275 | t271, t28, t281, t284, t285, t289, t29, t293, t297, t3, t30, t304, t31, t311, t312, t313, & - | ^ -note: 't271' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: + 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 + | ^ +Warning: 't671' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3247:26: - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't270' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:94: + 3247 | t1186 = t670*t186 + | ^ +Warning: 't670' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & - | ^ -note: 't270' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) + | ^ +Warning: 't665' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: Warning: 't660' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 687 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't265' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:83: + 3409 | *t234*t1737*t452) + | ^ +Warning: 't659' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: - 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & - | ^ -note: 't265' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: + 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) + | ^ +Warning: 't658' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 687 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't264' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:77: + 3409 | *t234*t1737*t452) + | ^ +Warning: 't656' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: - 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & - | ^ -note: 't264' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: + 3453 | *t407) + | ^ +Warning: 't652' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: - 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 - | ^ -Warning: 't259' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:66: + 3348 | (4._dp*t510*t552) + | ^ +Warning: 't650' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & - | ^ -note: 't259' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: + 3409 | *t234*t1737*t452) + | ^ +Warning: 't644' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: - 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:60: + 3348 | (4._dp*t510*t552) + | ^ +Warning: 't641' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & - | ^ -note: 't258' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: + 3409 | *t234*t1737*t452) + | ^ +Warning: 't638' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: - 673 | *t244*my_ndrho/t657/t7*t669) - | ^ -Warning: 't255' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:54: + 3453 | *t407) + | ^ +Warning: 't635' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: - 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & - | ^ -note: 't255' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: + 3533 | - (5._dp*t1726*t506*t6*t407) + | ^ +Warning: 't634' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 673 | *t244*my_ndrho/t657/t7*t669) - | ^ -Warning: 't254' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:48: + 3409 | *t234*t1737*t452) + | ^ +Warning: 't633' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: - 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & - | ^ -note: 't254' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: + 3453 | *t407) + | ^ +Warning: 't629' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3351:26: - 673 | *t244*my_ndrho/t657/t7*t669) - | ^ -Warning: 't251' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:42: + 3351 | t1545 = t628*t238 + | ^ +Warning: 't628' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & - | ^ -note: 't251' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't626' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: - 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:36: + 3453 | *t407) + | ^ +Warning: 't622' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: - 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & - | ^ -note: 't250' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: + 3364 | *t58 + | ^ +Warning: 't620' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: - 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) - | ^ -Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:30: + 3453 | *t407) + | ^ +Warning: 't615' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: - 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & - | ^ -note: 't245' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: + 3364 | *t58 + | ^ +Warning: 't612' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3496:32: - 673 | *t244*my_ndrho/t657/t7*t669) - | ^ -Warning: 't244' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:24: + 3496 | *(t607)*(t2111) + | ^ +Warning: 't608' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: - 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & - | ^ -note: 't244' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: + 3595 | /0.4e1_dp*t603*t1469*t2473 + | ^ +Warning: 't607' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3496:32: - 673 | *t244*my_ndrho/t657/t7*t669) - | ^ -Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:18: + 3496 | *(t607)*(t2111) + | ^ +Warning: 't605' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3339:60: - 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & - | ^ -note: 't241' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: + 3339 | *t1333) + | ^ +Warning: 't604' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: - 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 - | ^ -Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:274:12: + 3595 | /0.4e1_dp*t603*t1469*t2473 + | ^ +Warning: 't603' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3339:60: - 274 | t24, t241, t244, t245, t250, t251, t254, t255, t258, t259, t26, t264, t265, t27, t270, & - | ^ -note: 't24' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: + 3339 | *t1333) + | ^ +Warning: 't596' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: - 673 | *t244*my_ndrho/t657/t7*t669) - | ^ -Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:97: + 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 + | ^ +Warning: 't595' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3339:60: - 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & - | ^ -note: 't237' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: + 3339 | *t1333) + | ^ +Warning: 't591' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: - 673 | *t244*my_ndrho/t657/t7*t669) - | ^ -Warning: 't233' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:91: + 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 + | ^ +Warning: 't588' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3327:85: - 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & - | ^ -note: 't233' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: + 3327 | *t1430*t1151) - t1434*t1435*t452 + | ^ +Warning: 't587' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: - 673 | *t244*my_ndrho/t657/t7*t669) - | ^ -Warning: 't232' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:85: + 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 + | ^ +Warning: 't585' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3327:85: - 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & + 3327 | *t1430*t1151) - t1434*t1435*t452 | ^ -note: 't232' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: - - 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't230' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:73: +Warning: 't584' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: - 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & - | ^ -note: 't230' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:371:34: + 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) + | ^ +Warning: 't583' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: - 371 | t104 = 0.1e1_dp/t23 + 3348 | (4._dp*t510*t552) | ^ -Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:67: - - 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & - | ^ -note: 't23' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - - 673 | *t244*my_ndrho/t657/t7*t669) - | ^ -Warning: 't226' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:62: - - 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & - | ^ -note: 't226' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:740:80: - - 740 | *t397 - 0.2400000000e2_dp*t245/t657/my_rho*t669) - | ^ -Warning: 't225' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:56: - - 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & - | ^ -note: 't225' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:673:58: - - 673 | *t244*my_ndrho/t657/t7*t669) - | ^ -Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:50: - - 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & - | ^ -note: 't222' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:599:30: - - 599 | t628 = t221*t76 - | ^ -Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:44: +Warning: 't577' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3413:26: - 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & - | ^ -note: 't221' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:350:37: + 3413 | t1768 = t569*t407 + | ^ +Warning: 't569' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 350 | t68 = my_rho*t22*omega - | ^ -Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:38: + 3409 | *t234*t1737*t452) + | ^ +Warning: 't566' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: Warning: 't565' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: Warning: 't561' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3390:26: - 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & - | ^ -note: 't22' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:613:63: + 3390 | t1732 = t558*t513 + | ^ +Warning: 't558' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 613 | /t69*t669) - | ^ -Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:33: + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) + | ^ +Warning: 't552' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: - 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & - | ^ -note: 't219' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: + 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 + | ^ +Warning: 't551' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: - 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 - | ^ -Warning: 't216' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:273:27: + 3348 | (4._dp*t510*t552) + | ^ +Warning: 't549' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3538:27: - 273 | REAL(kind=dp) :: t216, t219, t22, t221, t222, t225, t226, t23, t230, t231, t232, t233, t237, & + 3538 | t2283 = t541*t1139 | ^ -note: 't216' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:658:67: - - 658 | t68*t60*t677 - 0.2222222224e0_dp*t24*t98*t842 - | ^ -Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:70: - - 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 - | ^ -note: 't213' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: - - 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:64: - - 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 - | ^ -note: 't212' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:725:76: - - 725 | t601*t172 - 0.2222222224e0_dp*t24*t98*(t1009 + t1141) - | ^ -Warning: 't211' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:58: - - 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 - | ^ -note: 't211' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:463:30: +Warning: 't541' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3381:69: - 463 | t311 = t126*t21 - | ^ -Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:52: + 3381 | - 0.3e1_dp/0.4e1_dp*t243*t1159 + t243*t1162/0.2e1_dp + | ^ +Warning: 't536' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3467:44: - 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 - | ^ -note: 't21' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: + 3467 | t1785 + t243*t1788/0.2e1_dp + | ^ +Warning: 't535' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3417:26: - 784 | t98*t1400 - | ^ -Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:47: + 3417 | t1791 = t531*t407 + | ^ +Warning: 't531' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3381:69: - 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 - | ^ -note: 't207' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:494:30: + 3381 | - 0.3e1_dp/0.4e1_dp*t243*t1159 + t243*t1162/0.2e1_dp + | ^ +Warning: 't530' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3381:69: Warning: 't524' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3387:30: - 494 | t365 = t27*t200 + 3387 | t1691 = 0.1e1_dp/t523 | ^ -Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:41: +Warning: 't523' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3371:26: - 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 - | ^ -note: 't200' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:577:29: + 3371 | t1619 = t522*t220 + | ^ +Warning: 't522' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: - 577 | t576 = t2*t501 - | ^ -Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:35: + 3476 | - t852*t519 + f12*t2053*t94 + | ^ +Warning: 't519' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: - 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 - | ^ -note: 't2' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:544:70: + 3533 | - (5._dp*t1726*t506*t6*t407) + | ^ +Warning: 't516' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 544 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 - | ^ -Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:31: + 3409 | *t234*t1737*t452) + | ^ +Warning: 't514' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3477:26: - 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 - | ^ -note: 't196' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: + 3477 | t2060 = t759*t513 + | ^ +Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3235:34: - 708 | t41*t328*t466 - | ^ -Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:25: + 3235 | t1149 = 0.1e1_dp/t512/t82 + | ^ +Warning: 't512' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: - 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 - | ^ -note: 't190' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: + 3453 | *t407) + | ^ +Warning: 't510' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:19: + 3533 | - (5._dp*t1726*t506*t6*t407) + | ^ +Warning: 't507' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: Warning: 't506' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: - 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 - | ^ -note: 't186' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: + 3348 | (4._dp*t510*t552) + | ^ +Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:272:13: + 3364 | *t58 + | ^ +Warning: 't503' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: Warning: 't496' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: - 272 | t185, t186, t190, t196, t2, t200, t207, t21, t211, t212, t213 - | ^ -note: 't185' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:407:59: + 3533 | - (5._dp*t1726*t506*t6*t407) + | ^ +Warning: 't491' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: - 407 | t172 = 0.40e1_dp*t11*t18 - 0.20e1_dp*t6*t169 + 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 | ^ -Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:96: - - 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & - | ^ -note: 't18' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: +Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:91: + 3409 | *t234*t1737*t452) + | ^ +Warning: 't487' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3296:39: - 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & - | ^ -note: 't177' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:549:69: + 3296 | *(t474)*(t481)*(t1351) + | ^ +Warning: 't483' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3281:27: - 549 | *t24*t98*t496)*sx - | ^ -Warning: 't173' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:79: + 3281 | t1333 = t1332*t482 + | ^ +Warning: 't482' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: - 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & - | ^ -note: 't173' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:586:35: + 3595 | /0.4e1_dp*t603*t1469*t2473 + | ^ +Warning: 't481' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: - 586 | *t36*t38*t586 - | ^ -Warning: 't172' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:73: + 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) + | ^ +Warning: 't480' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3521:65: - 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & - | ^ -note: 't172' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:353:28: + 3521 | *t2072 + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2111) + | ^ +Warning: 't476' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3339:60: - 353 | t72 = t71*t17 - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:67: + 3339 | *t1333) + | ^ +Warning: 't475' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3296:39: - 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & - | ^ -note: 't17' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:562:41: + 3296 | *(t474)*(t481)*(t1351) + | ^ +Warning: 't474' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3330:26: - 562 | - 0.20e1_dp*t6*t526 - | ^ -Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:62: + 3330 | t1453 = t125*t470 + | ^ +Warning: 't470' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: - 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & - | ^ -note: 't169' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:497:31: + 3471 | t404 - t733*t365 + 2._dp*t85*t1073 - t85*t1090) + | ^ +Warning: 't468' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3276:132: - 497 | t377 = t225*t168 - | ^ -Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:56: + 3276 | *t979*t68 - 2._dp*t464*t365 + 2._dp*t85*t989 - t85*t1022)) + | ^ +Warning: 't467' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: - 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & - | ^ -note: 't168' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:434:38: + 3471 | t404 - t733*t365 + 2._dp*t85*t1073 - t85*t1090) + | ^ +Warning: 't464' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: Warning: 't461' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: Warning: 't458' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3276:132: - 434 | t230 = 0.1e1_dp/t75/t16 - | ^ -Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:50: + 3276 | *t979*t68 - 2._dp*t464*t365 + 2._dp*t85*t989 - t85*t1022)) + | ^ +Warning: 't457' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3296:39: - 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & - | ^ -note: 't16' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:424:30: + 3296 | *(t474)*(t481)*(t1351) + | ^ +Warning: 't454' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 424 | t207 = t27*t155 - | ^ -Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:38: + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) + | ^ +Warning: 't453' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: - 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & - | ^ -note: 't155' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:488:68: + 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 + | ^ +Warning: 't452' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: - 488 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 - | ^ -Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:32: + 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) + | ^ +Warning: 't448' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3486:32: - 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & + 3486 | t2099 = t447*t127*t2071 | ^ -note: 't151' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:539:82: - - 539 | - 0.5555555558e-1_dp*t146*t486 - 0.5000000001e0_dp*t489*t466 - | ^ -Warning: 't148' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:26: +Warning: 't447' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3514:70: - 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & - | ^ -note: 't148' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: + 3514 | t2195*t2099 + 0.5e1_dp/0.2e1_dp*(t440)*(t448)*(t1946) + | ^ +Warning: 't443' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: - 708 | t41*t328*t466 - | ^ -Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:271:13: + 3533 | - (5._dp*t1726*t506*t6*t407) + | ^ +Warning: 't442' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: Warning: 't441' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3296:39: - 271 | t147, t1472, t148, t151, t155, t1553, t16, t168, t169, t17, t172, t173, t176, t177, t18, & - | ^ -note: 't147' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:708:36: + 3296 | *(t474)*(t481)*(t1351) + | ^ +Warning: 't440' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3316:26: - 708 | t41*t328*t466 - | ^ -Warning: 't146' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:270:87: + 3316 | t1407 = t110*t436 + | ^ +Warning: 't436' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: - 270 | t1370, t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, & - | ^ -note: 't146' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:539:82: + 3459 | - (16._dp*t752*t331)) + | ^ +Warning: 't434' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: - 539 | - 0.5555555558e-1_dp*t146*t486 - 0.5000000001e0_dp*t489*t466 - | ^ -Warning: 't143' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:270:67: + 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) + | ^ +Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: 't423' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: - 270 | t1370, t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, & + 3459 | - (16._dp*t752*t331)) | ^ -note: 't143' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:476:35: +Warning: 't420' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: - 476 | t343 = t141*t135*t46 - | ^ -Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:270:54: + 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) + | ^ +Warning: 't416' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: - 270 | t1370, t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, & - | ^ -note: 't141' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:811:74: + 3533 | - (5._dp*t1726*t506*t6*t407) + | ^ +Warning: 't413' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3535:89: - 811 | *t1449*t52 - 0.5000000001e0_dp*t41*t1449*t46) - | ^ -Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:270:27: + 3535 | t2274)*Clda)*sx + | ^ +Warning: 't409' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: - 270 | t1370, t1396, t140, t1400, t1404, t1405, t141, t1412, t143, t1449, t1456, t146, t1467, & - | ^ -note: 't140' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:637:40: + 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 + | ^ +Warning: 't407' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3232:46: - 637 | REAL(t46, KIND=dp) - | ^ -Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:96: + 3232 | *t303*t1119 - t338*t303*t1136 + | ^ +Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: - 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & - | ^ -note: 't137' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:701:68: + 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) + | ^ +Warning: 't404' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: - 701 | *t335*t486 - 0.1000000001e1_dp*t94*t135*t1091 - | ^ -Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:90: + 3222 | *t303*t1073 - t338*t303*t1090 + | ^ +Warning: 't403' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: - 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & - | ^ -note: 't136' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:535:30: + 3216 | *t355) - (48._dp*t400*t361)) + | ^ +Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: 't396' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: 't395' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: 't392' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: 't391' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3232:46: - 535 | t489 = t41*t135 - | ^ -Warning: 't135' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:84: + 3232 | *t303*t1119 - t338*t303*t1136 + | ^ +Warning: 't389' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: - 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & - | ^ -note: 't135' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:450:69: + 3222 | *t303*t1073 - t338*t303*t1090 + | ^ +Warning: 't388' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3209:25: - 450 | t264 = 0.9000000000e1_dp*t130 - 0.6000000000e1_dp*t133 - | ^ -Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:57: + 3209 | t1034 = t14*t387 + | ^ +Warning: 't387' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3211:73: - 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & - | ^ -note: 't133' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:745:57: + 3211 | - 0.16e2_dp/0.3e1_dp*t383*t324*t327 - (16._dp*t384*t331) + | ^ +Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3211:73: Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: - 745 | + 0.5999999999e1_dp*t128*t132*t529 - | ^ -Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:51: + 3229 | + 30._dp*a5*t21*t54*t65) + | ^ +Warning: 't382' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3211:73: - 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & - | ^ -note: 't132' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:450:69: + 3211 | - 0.16e2_dp/0.3e1_dp*t383*t324*t327 - (16._dp*t384*t331) + | ^ +Warning: 't379' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3211:73: Warning: 't378' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: - 450 | t264 = 0.9000000000e1_dp*t130 - 0.6000000000e1_dp*t133 - | ^ -Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:45: + 3222 | *t303*t1073 - t338*t303*t1090 + | ^ +Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3212:25: - 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & - | ^ -note: 't130' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:468:35: + 3212 | t1067 = t374*t18 + | ^ +Warning: 't374' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3467:44: - 468 | t321 = t128*t43*t258 - | ^ -Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:32: + 3467 | t1785 + t243*t1788/0.2e1_dp + | ^ +Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & - | ^ -note: 't128' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:530:30: + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) + | ^ +Warning: 't369' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: - 530 | t473 = t94*t127 - | ^ -Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:26: + 3222 | *t303*t1073 - t338*t303*t1090 + | ^ +Warning: 't366' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: - 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & - | ^ -note: 't127' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:463:30: + 3471 | t404 - t733*t365 + 2._dp*t85*t1073 - t85*t1090) + | ^ +Warning: 't365' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3213:31: - 463 | t311 = t126*t21 - | ^ -Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:269:20: + 3213 | t1073 = t987*t364*t403 + | ^ +Warning: 't364' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: - 269 | t1220, t126, t127, t128, t1284, t130, t132, t133, t1334, t1341, t1345, t135, t136, t137, & - | ^ -note: 't126' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:544:70: + 3216 | *t355) - (48._dp*t400*t361)) + | ^ +Warning: 't361' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: 't355' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: - 544 | *t117*t297*t172 + 0.3333333334e0_dp*t36*t38*t492 - | ^ -Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:92: + 3202 | /t12*t63)) + | ^ +Warning: 't353' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: - 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & - | ^ -note: 't122' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:405:67: + 3216 | *t355) - (48._dp*t400*t361)) + | ^ +Warning: 't349' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: - 405 | t168 = 0.60e1_dp*beta*t3*t12 + 0.60e1_dp*t11*t10*t86 + 3202 | /t12*t63)) | ^ -Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:86: - - 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & - | ^ -note: 't12' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:488:68: +Warning: 't348' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: - 488 | t36*t122*t151 + 0.3333333334e0_dp*t36*t38*t354 - | ^ -Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:81: + 3216 | *t355) - (48._dp*t400*t361)) + | ^ +Warning: 't346' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: - 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & - | ^ -note: 't118' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: + 3202 | /t12*t63)) + | ^ +Warning: 't341' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: - 775 | *t36*t38*t1396 - | ^ -Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:68: + 3229 | + 30._dp*a5*t21*t54*t65) + | ^ +Warning: 't340' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3194:33: - 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & - | ^ -note: 't117' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:784:32: + 3194 | t987 = 0.1e1_dp/t339/t67 + | ^ +Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3203:32: - 784 | t98*t1400 + 3203 | t1024 = t338*t303*t1022 | ^ -Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:268:48: - - 268 | t1136, t1141, t1146, t1153, t1156, t116, t1163, t1167, t117, t1177, t118, t12, t122, & - | ^ -note: 't116' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:775:37: +Warning: 't338' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: - 775 | *t36*t38*t1396 - | ^ -Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:96: + 3222 | *t303*t1073 - t338*t303*t1090 + | ^ +Warning: 't336' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3178:35: - 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & - | ^ -note: 't113' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:687:57: + 3178 | t950 = 4._dp*t11*t311*t335 + | ^ +Warning: 't335' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3171:24: - 687 | - 0.1111111111e0_dp*t117*t293*t404 - | ^ -Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:90: + 3171 | t933 = t14*t334 + | ^ +Warning: 't334' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: - 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & - | ^ -note: 't112' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:793:102: + 3459 | - (16._dp*t752*t331)) + | ^ +Warning: 't331' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't327' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3186:25: - 793 | *t250*my_ndrho + 0.180e2_dp*t393/t657*t669) - | ^ -Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:77: + 3186 | t968 = t326*t275 + | ^ +Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: - 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & - | ^ -note: 't11' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:515:66: + 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) + | ^ +Warning: 't325' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: - 515 | *t31*t404 - 0.5000000000e0_dp*t105*t109*t172 - | ^ -Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:65: + 3459 | - (16._dp*t752*t331)) + | ^ +Warning: 't324' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3179:23: - 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & - | ^ -note: 't109' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:586:35: + 3179 | t951 = t4*t320 + | ^ +Warning: 't320' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: - 586 | *t36*t38*t586 - | ^ -Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:52: + 3459 | - (16._dp*t752*t331)) + | ^ +Warning: 't317' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: - 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & - | ^ -note: 't105' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:595:39: + 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) + | ^ +Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: - 595 | t605 = my_rho*t104*omega - | ^ -Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:39: + 3459 | - (16._dp*t752*t331)) + | ^ +Warning: 't315' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: - 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & - | ^ -note: 't104' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:586:35: + 3222 | *t303*t1073 - t338*t303*t1090 + | ^ +Warning: 't312' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: - 586 | *t36*t38*t586 - | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:267:33: + 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) + | ^ +Warning: 't311' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3169:27: - 267 | t1009, t101, t1013, t103, t104, t1044, t105, t1069, t109, t1091, t11, t1102, t112, t113, & - | ^ -note: 't103' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:405:67: + 3169 | t930 = t4*t44*t310 + | ^ +Warning: 't310' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: - 405 | t168 = 0.60e1_dp*beta*t3*t12 + 0.60e1_dp*t11*t10*t86 + 3202 | /t12*t63)) | ^ -Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:266:83: +Warning: 't309' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: - 266 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, my_ndrho, my_rho, t1, t10, t100, t1002, & - | ^ -note: 't10' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:417:69: + 3222 | *t303*t1073 - t338*t303*t1090 + | ^ +Warning: 't306' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: Warning: 't305' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3197:36: - 417 | t117*t118*t172 + 0.3333333334e0_dp*t36*t38*t196 - | ^ -Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F:266:78: + 3197 | t992 = 2._dp*t338*t303*t989 + | ^ +Warning: 't303' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: - 266 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, my_ndrho, my_rho, t1, t10, t100, t1002, & - | ^ -note: 't1' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xbecke88_long_range.mod' due to: xc_xbecke88_long_range.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_long_range.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod cp_array_utils.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_hcth.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_hcth.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod cp_log_handling.mod mathconstants.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_hcth.F xc_hcth.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:07:00 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_hcth.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_hcth.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_hcth.mod' due to: xc_hcth.o /build/reproducible-path/cp2k-8.1/src/xc/xc_hcth.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod cp_log_handling.mod mathconstants.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_tpss.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_tpss.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod cp_log_handling.mod mathconstants.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_tpss.F xc_tpss.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:07:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_tpss.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_tpss.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_tpss.mod' due to: xc_tpss.o /build/reproducible-path/cp2k-8.1/src/xc/xc_tpss.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod cp_log_handling.mod mathconstants.mod base_hooks.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_lyp_adiabatic.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F xc_lyp_adiabatic.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:07:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_lyp_adiabatic.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_lyp_adiabatic.F90 -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:656:132: + 3222 | *t303*t1073 - t338*t303*t1090 + | ^ +Warning: 't302' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3208:26: - 656 | + t18*t90*t421*d - REAL(2*t95*t96*my_rhob*t108*my_ndrho, dp)) - | ^ -Warning: 't96' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:91: + 3208 | t1031 = t374*t301 + | ^ +Warning: 't301' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't96' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:656:132: + 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) + | ^ +Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: 't96' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3521:65: - 656 | + t18*t90*t421*d - REAL(2*t95*t96*my_rhob*t108*my_ndrho, dp)) - | ^ + 3521 | *t2072 + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2111) + | ^ Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:86: - - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't95' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:643:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: - 643 | my_ndrhoa, dp) - 0.2222222222e0_dp*t115*my_rhoa*t355)) - | ^ + 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 + | ^ Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:81: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't94' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:600:40: + 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) + | ^ +Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3007:22: - 600 | t250 = 4*t18*t78*t141*t91 - | ^ -Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:76: + 3007 | t512 = t92**2 + | ^ +Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't91' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: + 3409 | *t234*t1737*t452) + | ^ +Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3279:30: - 619 | t300 - 0.1111111111e0_dp*t115*t188) - | ^ + 3279 | t1331 = t140*t90*t108 + | ^ Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:71: - - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't90' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:592:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: - 592 | t216 = 0.1e1_dp/t77/t9 - | ^ + 3364 | *t58 + | ^ Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't9' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:597:59: + 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) + | ^ +Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3276:132: - 597 | t231 = t14*t223*t225*lambda*t17*t87/0.3e1_dp - | ^ + 3276 | *t979*t68 - 2._dp*t464*t365 + 2._dp*t85*t989 - t85*t1022)) + | ^ Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:62: - - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't87' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: - - 619 | t300 - 0.1111111111e0_dp*t115*t188) - | ^ -Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't86' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:569:38: + 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) + | ^ +Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: - 569 | t153 = 0.1e1_dp/t21/t84 - | ^ + 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 + | ^ Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:47: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't84' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:631:108: + 3595 | /0.4e1_dp*t603*t1469*t2473 + | ^ +Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3235:34: - 631 | - t300 - 0.1111111111e0_dp*t115*t316) - | ^ + 3235 | t1149 = 0.1e1_dp/t512/t82 + | ^ +Warning: 't82' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3614:71: + + 3614 | e_ndrho_ndrho = e_ndrho_ndrho + (-t80*(t2391 + t2668)*Clda)*sx + | ^ Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't80' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:606:42: + 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 + | ^ +Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3234:23: - 606 | t280 = t102*t169*t78*lambda - | ^ + 3234 | t1141 = t78**2 + | ^ Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:32: - - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't78' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:592:37: - - 592 | t216 = 0.1e1_dp/t77/t9 - | ^ -Warning: 't77' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:27: - - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't77' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:605:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3418:30: - 605 | t276 = d*t76*t10 - | ^ -Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:22: + 3418 | t1795 = t75*t372*t407 + | ^ +Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3206:62: - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't76' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:593:71: + 3206 | + t992 - t1024 + 0.10e2_dp/0.9e1_dp*t73*t1026 + | ^ +Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 593 | t220 = 0.26666666666666666667e1_dp*t74/t21/t19*t216*t103 - | ^ -Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:17: + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) + | ^ +Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2957:53: - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't74' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:656:132: + 2957 | t407 = 2._dp*t375*t70 + t11*t389 - t338*t405 + | ^ +Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3177:34: - 656 | + t18*t90*t421*d - REAL(2*t95*t96*my_rhob*t108*my_ndrho, dp)) - | ^ -Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:12: + 3177 | t947 = 6._dp*t11*t944*t69 + | ^ +Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: - 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 - | ^ -note: 't73' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:599:66: + 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) + | ^ +Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2921:22: - 599 | t246 = 0.2e1_dp/0.3e1_dp*t14*t17*t216*t225*t67*t103 - | ^ + 2921 | t339 = t67**2 + | ^ Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:90: - - 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & - | ^ -note: 't67' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:639:61: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: - 639 | *t355) + REAL(2*t65*my_ndrhoa, dp) - | ^ + 3229 | + 30._dp*a5*t21*t54*t65) + | ^ Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:85: - - 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & - | ^ -note: 't65' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:647:61: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: - 647 | *t387) + REAL(2*t63*my_ndrhob, dp) - | ^ + 3202 | /t12*t63)) + | ^ Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:80: - - 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & - | ^ -note: 't63' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:561:41: - - 561 | t135 = 0.1e1_dp/t6/t19*t78 - | ^ -Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2930:31: - 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & - | ^ -note: 't6' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:627:67: + 2930 | t361 = t60/t61/rho*t63 + | ^ +Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: - 627 | *t48 + (t199 - 0.6666666667e0_dp*my_rhob)*t47 + 3202 | /t12*t63)) | ^ -Warning: 't58' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:66: - - 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & - | ^ -note: 't58' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:615:60: - - 615 | /0.3e1_dp*t285)*t55 - | ^ Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:61: - - 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & - | ^ -note: 't55' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:639:61: - - 639 | *t355) + REAL(2*t65*my_ndrhoa, dp) - | ^ -Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:56: - - 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & - | ^ -note: 't51' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:568:51: - - 568 | t151 = t14*t146*t141*t67*t5/0.3e1_dp - | ^ -Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:51: - - 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & - | ^ -note: 't5' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:613:26: - - 613 | *t49 - | ^ -Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:47: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: - 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & + 3229 | + 30._dp*a5*t21*t54*t65) | ^ -note: 't49' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:590:132: - - 590 | *my_rhoa + t196)*t48 + t200*t47 - | ^ -Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:42: - - 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & - | ^ -note: 't48' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:627:67: +Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: - 627 | *t48 + (t199 - 0.6666666667e0_dp*my_rhob)*t47 + 3202 | /t12*t63)) | ^ -Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:37: - - 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & - | ^ -note: 't47' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:639:61: +Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3187:26: - 639 | *t355) + REAL(2*t65*my_ndrhoa, dp) - | ^ + 3187 | t972 = t46*t31*t6 + | ^ Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & - | ^ -note: 't46' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:610:26: + 3409 | *t234*t1737*t452) + | ^ +Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: - 610 | *t42 - | ^ + 3202 | /t12*t63)) + | ^ Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:463:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3179:23: - 463 | t32, t325, t348, t351, t355, t362, t387, t39, t394, t4, t41, t42 - | ^ -note: 't42' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:653:103: + 3179 | t951 = t4*t320 + | ^ +Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: - 653 | t421 = REAL(2*t25*t41*my_ndrho, dp) - 0.1333333333e1_dp*REAL(t19, dp)*REAL(my_ndrho, dp) - | ^ -Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:463:68: + 3202 | /t12*t63)) + | ^ +Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2953:26: - 463 | t32, t325, t348, t351, t355, t362, t387, t39, t394, t4, t41, t42 - | ^ -note: 't41' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:627:67: + 2953 | t400 = a5*t38*t54 + | ^ +Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: - 627 | *t48 + (t199 - 0.6666666667e0_dp*my_rhob)*t47 + 3202 | /t12*t63)) | ^ -Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:463:12: +Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3174:24: - 463 | t32, t325, t348, t351, t355, t362, t387, t39, t394, t4, t41, t42 - | ^ -note: 't32' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:645:34: + 3174 | t939 = t34*t340 + | ^ +Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3567:93: - 645 | t387 = t3*my_ndrhob - | ^ -Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:462:69: + 3567 | t3*t19 + 12._dp*g3*t1*t24*t32) + | ^ +Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3188:28: - 462 | t266, t27, t270, t273, t276, t28, t280, t285, t288, t294, t3, t30, t300, t307, t31, t316, & - | ^ -note: 't3' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:590:132: + 3188 | t976 = t27*t353*t31 + | ^ +Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3411:85: - 590 | *my_rhoa + t196)*t48 + t200*t47 - | ^ -Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:462:41: + 3411 | t727 - t80*(t1392 + t1517 + t1577 + t1742)*Clda)*sx + | ^ +Warning: 't299' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 462 | t266, t27, t270, t273, t276, t28, t280, t285, t288, t294, t3, t30, t300, t307, t31, t316, & - | ^ -note: 't28' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:647:61: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't296' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: - 647 | *t387) + REAL(2*t63*my_ndrhob, dp) - | ^ -Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:461:76: + 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 + | ^ +Warning: 't295' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 461 | t212, t216, t220, t222, t223, t225, t23, t231, t237, t24, t246, t25, t250, t259, t26, & - | ^ -note: 't25' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) + | ^ +Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3081:25: - 619 | t300 - 0.1111111111e0_dp*t115*t188) - | ^ -Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:461:65: + 3081 | t681 = t292*t293 + | ^ +Warning: 't292' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: - 461 | t212, t216, t220, t222, t223, t225, t23, t231, t237, t24, t246, t25, t250, t259, t26, & - | ^ -note: 't24' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:643:132: + 3348 | (4._dp*t510*t552) + | ^ +Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 643 | my_ndrhoa, dp) - 0.2222222222e0_dp*t115*my_rhoa*t355)) + 3409 | *t234*t1737*t452) | ^ -Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:461:48: - - 461 | t212, t216, t220, t222, t223, t225, t23, t231, t237, t24, t246, t25, t250, t259, t26, & - | ^ -note: 't23' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:593:71: - - 593 | t220 = 0.26666666666666666667e1_dp*t74/t21/t19*t216*t103 - | ^ -Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:460:92: +Warning: 't284' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: - 460 | t174, t179, t18, t183, t186, t187, t188, t19, t194, t196, t199, t2, t200, t202, t21, & - | ^ -note: 't21' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:584:46: + 3348 | (4._dp*t510*t552) + | ^ +Warning: 't282' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3302:32: - 584 | t194 = 0.1333333333e1_dp*t2*t42 - | ^ -Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:460:75: + 3302 | t1385 = t1382*t1383*t28 + | ^ +Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 460 | t174, t179, t18, t183, t186, t187, t188, t19, t194, t196, t199, t2, t200, t202, t21, & - | ^ -note: 't2' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:653:103: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't279' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3256:29: - 653 | t421 = REAL(2*t25*t41*my_ndrho, dp) - 0.1333333333e1_dp*REAL(t19, dp)*REAL(my_ndrho, dp) - | ^ -Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:460:53: + 3256 | t1243 = t278*t56*t58 + | ^ +Warning: 't278' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 460 | t174, t179, t18, t183, t186, t187, t188, t19, t194, t196, t199, t2, t200, t202, t21, & + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) | ^ -note: 't19' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: - - 619 | t300 - 0.1111111111e0_dp*t115*t188) - | ^ -Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:460:24: +Warning: 't274' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3086:25: - 460 | t174, t179, t18, t183, t186, t187, t188, t19, t194, t196, t199, t2, t200, t202, t21, & - | ^ -note: 't18' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:597:59: + 3086 | t695 = t273*t274 + | ^ +Warning: 't273' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3188:28: - 597 | t231 = t14*t223*t225*lambda*t17*t87/0.3e1_dp - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:459:88: + 3188 | t976 = t27*t353*t31 + | ^ +Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3373:38: - 459 | t140, t141, t143, t145, t146, t15, t151, t153, t157, t16, t162, t165, t169, t17, t171, & - | ^ -note: 't17' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:571:29: + 3373 | t1630 = f2732/t258/t1626/t213 + | ^ +Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3388:25: - 571 | t162 = t15*t76 - | ^ -Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:459:42: + 3388 | t1699 = f94/t257 + | ^ +Warning: 't257' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3155:58: - 459 | t140, t141, t143, t145, t146, t15, t151, t153, t157, t16, t162, t165, t169, t17, t171, & - | ^ -note: 't15' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: + 3155 | *t862/0.2e1_dp) + t270*t830)*alpha7 + | ^ +Warning: 't256' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3368:41: - 619 | t300 - 0.1111111111e0_dp*t115*t188) - | ^ -Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:49: + 3368 | t1613 = 0.1e1_dp/t253/t1178/t523 + | ^ +Warning: 't253' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3012:34: - 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & - | ^ -note: 't119' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:631:108: + 3012 | t522 = 0.1e1_dp/t253/t252 + | ^ +Warning: 't252' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: - 631 | - t300 - 0.1111111111e0_dp*t115*t316) - | ^ -Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:43: + 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) + | ^ +Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: - 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & - | ^ -note: 't118' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:643:132: + 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 + | ^ +Warning: 't249' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: - 643 | my_ndrhoa, dp) - 0.2222222222e0_dp*t115*my_rhoa*t355)) - | ^ -Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:37: + 3348 | (4._dp*t510*t552) + | ^ +Warning: 't248' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: - 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & - | ^ -note: 't115' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:643:132: + 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 + | ^ +Warning: 't247' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: Warning: 't239' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 643 | my_ndrhoa, dp) - 0.2222222222e0_dp*t115*my_rhoa*t355)) - | ^ -Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:31: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't238' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3350:25: - 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & - | ^ -note: 't113' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:656:132: + 3350 | t1538 = t75*t236 + | ^ +Warning: 't236' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: - 656 | + t18*t90*t421*d - REAL(2*t95*t96*my_rhob*t108*my_ndrho, dp)) - | ^ -Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:25: + 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 + | ^ +Warning: 't234' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3063:25: - 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & + 3063 | t633 = t233*t154 | ^ -note: 't108' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:599:66: +Warning: 't233' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3245:41: - 599 | t246 = 0.2e1_dp/0.3e1_dp*t14*t17*t216*t225*t67*t103 - | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:13: + 3245 | t1181 = 0.1e1_dp/t221/t1178/t185 + | ^ +Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3467:44: - 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & - | ^ -note: 't103' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: + 3467 | t1785 + t243*t1788/0.2e1_dp + | ^ +Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: - 619 | t300 - 0.1111111111e0_dp*t115*t188) - | ^ -Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:457:84: + 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) + | ^ +Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3384:27: - 457 | REAL(KIND=dp) :: cf, my_ndrho, my_ndrhoa, my_ndrhob, my_rhoa, my_rhob, t1, t10, t100, t102, & - | ^ -note: 't10' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:560:43: + 3384 | t1667 = t1666*t219 + | ^ +Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3242:40: - 560 | t132 = 0.40e1_dp*t1*t129*t10 - | ^ -Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:457:79: + 3242 | t1167 = 0.1e1_dp/t215/t256/t213 + | ^ +Warning: 't215' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3381:69: - 457 | REAL(KIND=dp) :: cf, my_ndrho, my_ndrhoa, my_ndrhob, my_rhoa, my_rhob, t1, t10, t100, t102, & - | ^ -note: 't1' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_lyp_adiabatic.mod' due to: xc_lyp_adiabatic.o /build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_pade.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_pade.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_pade.F xc_pade.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:07:10 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_pade.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_pade.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_pade.mod' due to: xc_pade.o /build/reproducible-path/cp2k-8.1/src/xc/xc_pade.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xwpbe.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathlib.mod mathconstants.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F xc_xwpbe.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:07:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xwpbe.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xwpbe.F90 -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5635:90: + 3381 | - 0.3e1_dp/0.4e1_dp*t243*t1159 + t243*t1162/0.2e1_dp + | ^ +Warning: 't214' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: - 5635 | 1.0_dp/Q*(dQrho*dQndrho + d2Qrhondrho) + 1.0_dp/(Q*Q)*dQrho*dQndrho - | ^ -Warning: 'dqrho' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:983:76: + 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 + | ^ +Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: - 983 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & - | ^ -note: 'dqrho' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5671:94: + 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 + | ^ +Warning: 't210' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: - 5671 | 1.0_dp/(Q*Q)*(-Q*dQndrho*dQndrho - Q*d2Qndrhondrho + dQndrho*dQndrho) - | ^ -Warning: 'dqndrho' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:983:69: + 3229 | + 30._dp*a5*t21*t54*t65) + | ^ +Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2998:25: - 983 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & - | ^ -note: 'dqndrho' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1416:88: + 2998 | t489 = t209*t153 + | ^ +Warning: 't209' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 1416 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t235*t408 - t76*t1073*Clda)*sx0 - | ^ -Warning: 't408' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't204' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: Warning: 't202' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: - 1438 | + t403*t1066 + t403*t1069) - | ^ -Warning: 't403' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: 't402' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: + 3364 | *t58 + | ^ +Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3238:35: - 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 - | ^ -Warning: 't399' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: 't398' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: 't396' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: 't395' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: 't393' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1423:41: + 3238 | t1157 = 0.1e1_dp/t190/t213 + | ^ +Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3114:47: - 1423 | *t1094 - t113*t114*t1098 - | ^ -Warning: 't392' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1423:41: Warning: 't389' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: + 3114 | t755 = 2._dp*t748*t19 + 4._dp*t752*t32 + | ^ +Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3383:35: - 1438 | + t403*t1066 + t403*t1069) - | ^ -Warning: 't385' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: 't380' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 3383 | t1666 = 0.1e1_dp/t187/t523 + | ^ +Warning: 't187' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't379' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't371' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) + | ^ +Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3092:25: - 1438 | + t403*t1066 + t403*t1069) - | ^ -Warning: 't366' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: 't364' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: Warning: 't361' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 3092 | t710 = t709*t185 + | ^ +Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3090:24: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't360' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't357' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: + 3090 | t705 = t182*t72 + | ^ +Warning: 't182' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3212:25: - 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 - | ^ -Warning: 't352' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1423:41: + 3212 | t1067 = t374*t18 + | ^ +Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 1423 | *t1094 - t113*t114*t1098 - | ^ -Warning: 't350' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3089:26: - 1438 | + t403*t1066 + t403*t1069) - | ^ -Warning: 't349' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1423:41: + 3089 | t702 = t176*omega + | ^ +Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: - 1423 | *t1094 - t113*t114*t1098 - | ^ -Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: + 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3000:30: - 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 - | ^ -Warning: 't346' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: + 3000 | t496 = t166/t167/t160 + | ^ +Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 1385 | *t902 - t113*t114*t906 - | ^ -Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1377:25: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't161' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: - 1377 | t874 = t342*t190 - | ^ -Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1375:54: + 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) + | ^ +Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 1375 | - t76*t865*Clda)*sx0 - | ^ -Warning: 't340' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - 1438 | + t403*t1066 + t403*t1069) - | ^ -Warning: 't335' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 3409 | *t234*t1737*t452) + | ^ +Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: - 1373 | *t331*t333*t253) + 3453 | *t407) | ^ -Warning: 't334' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't333' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't332' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1400:31: +Warning: 't154' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: - 1400 | t1069 = t331*t333*t352 - | ^ -Warning: 't331' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 3533 | - (5._dp*t1726*t506*t6*t407) + | ^ +Warning: 't153' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 1373 | *t331*t333*t253) - | ^ -Warning: 't330' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't329' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: + 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) + | ^ +Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: - 1438 | + t403*t1066 + t403*t1069) - | ^ -Warning: 't328' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 3364 | *t58 + | ^ +Warning: 't146' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 1373 | *t331*t333*t253) - | ^ -Warning: 't327' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't145' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3332:26: - 1438 | + t403*t1066 + t403*t1069) - | ^ -Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 3332 | t1473 = t125*t141 + | ^ +Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't325' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: + 3459 | - (16._dp*t752*t331)) + | ^ +Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3508:26: - 1396 | *t114*t321*t909 - | ^ -Warning: 't323' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: Warning: 't322' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1350:94: + 3508 | t2195 = t136*t137 + | ^ +Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 1350 | *t114*t820*t640) - (t113*t114*t321*t681) - | ^ -Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't134' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: - 1396 | *t114*t321*t909 - | ^ -Warning: 't319' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: Warning: 't318' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1350:94: + 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 + | ^ +Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3232:46: - 1350 | *t114*t820*t640) - (t113*t114*t321*t681) - | ^ -Warning: 't317' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: + 3232 | *t303*t1119 - t338*t303*t1136 + | ^ +Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: - 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 - | ^ -Warning: 't315' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1332:30: + 3595 | /0.4e1_dp*t603*t1469*t2473 + | ^ +Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3282:40: - 1332 | t113*t114*t678 - | ^ -Warning: 't314' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: + 3282 | t1341 = 0.1e1_dp/t128/t115/t114 + | ^ +Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 1385 | *t902 - t113*t114*t906 - | ^ -Warning: 't311' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) + | ^ +Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3479:26: - 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 - | ^ -Warning: 't308' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: Warning: 't307' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: + 3479 | t2069 = t125*t126 + | ^ +Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: - 1385 | *t902 - t113*t114*t906 - | ^ -Warning: 't305' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 + | ^ +Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3328:35: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't301' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 3328 | t1442 = 0.1e1_dp/t121/t114 + | ^ +Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2900:23: - 1373 | *t331*t333*t253) - | ^ -Warning: 't300' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1334:33: + 2900 | t309 = t12*rho + | ^ +Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: - 1334 | t759 = 0.1e1_dp/t299/t83 + 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) + | ^ +Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3265:41: + + 3265 | t1273 = 0.1e1_dp/t117/t1270/t114 + | ^ +Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2975:34: + + 2975 | t447 = 0.1e1_dp/t117/t116 + | ^ +Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3499:33: + + 3499 | t2155 = t1341*t115*t2071 | ^ -Warning: 't299' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: +Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3485:32: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't297' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't294' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 3485 | t2090 = t480*t114*t2071 + | ^ +Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3481:32: - 1373 | *t331*t333*t253) - | ^ -Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't288' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't283' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 3481 | t2072 = t480*t113*t2071 + | ^ +Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't280' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't277' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) + | ^ +Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3483:26: - 1373 | *t331*t333*t253) - | ^ -Warning: 't276' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 3483 | t2084 = t110*t111 + | ^ +Warning: 't111' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't273' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) + | ^ +Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: - 1373 | *t331*t333*t253) - | ^ -Warning: 't272' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) + | ^ +Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't270' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't267' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) + | ^ +Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3259:31: - 1373 | *t331*t333*t253) - | ^ -Warning: 't266' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 3259 | t1261 = t136*t105*t108 + | ^ +Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3567:93: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't263' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't260' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't257' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 3567 | t3*t19 + 12._dp*g3*t1*t24*t32) + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: - 1373 | *t331*t333*t253) - | ^ -Warning: 't256' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: + 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) + | ^ +Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: 't100' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2940:24: - 1396 | *t114*t321*t909 - | ^ -Warning: 't254' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 2940 | t375 = t374*t10 + | ^ +Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2943:24: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't253' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: + 2943 | t382 = t1*ndrho + | ^ +Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: - 1385 | *t902 - t113*t114*t906 - | ^ -Warning: 't251' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 2494 | *(t444) + | ^ +Warning: 't988' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: + 2479 | *t620*(t1240) + | ^ +Warning: 't982' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: - 1385 | *t902 - t113*t114*t906 - | ^ -Warning: 't248' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1350:94: + 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) + | ^ +Warning: 't972' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: Warning: 't971' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: Warning: 't965' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: - 1350 | *t114*t820*t640) - (t113*t114*t321*t681) - | ^ -Warning: 't247' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: + 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) + | ^ +Warning: 't962' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: - 1385 | *t902 - t113*t114*t906 - | ^ -Warning: 't244' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: Warning: 't240' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: Warning: 't238' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1416:88: + 2514 | *t156*t444 + | ^ +Warning: 't958' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: - 1416 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t235*t408 - t76*t1073*Clda)*sx0 - | ^ -Warning: 't235' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: + 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) + | ^ +Warning: 't954' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: Warning: 't951' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: Warning: 't945' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: Warning: 't942' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: - 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) - | ^ -Warning: 't232' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: + 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 + | ^ +Warning: 't937' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: - 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 + 2587 | t159 + (2._dp*t2267*t916) + (5._dp*t2267*t919) | ^ -Warning: 't231' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: Warning: 't229' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: +Warning: 't933' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2423:27: - 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) - | ^ -Warning: 't228' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: + 2423 | t2297 = t1305*t932 + | ^ +Warning: 't932' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: - 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 - | ^ -Warning: 't227' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: + 2587 | t159 + (2._dp*t2267*t916) + (5._dp*t2267*t919) + | ^ +Warning: 't930' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: Warning: 't919' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2408:27: - 1305 | (48._dp*t224*t181) - | ^ -Warning: 't224' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: 't216' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: 't215' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: + 2408 | t2258 = t1547*t918 + | ^ +Warning: 't918' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: - 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) - | ^ -Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1301:25: + 2587 | t159 + (2._dp*t2267*t916) + (5._dp*t2267*t919) + | ^ +Warning: 't916' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: - 1301 | t543 = t212*t156 - | ^ -Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1398:31: + 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) + | ^ +Warning: 't910' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2482:26: - 1398 | t1062 = t851*t852*t211 - | ^ -Warning: 't211' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1300:72: + 2482 | t2543 = t908*t620 + | ^ +Warning: 't908' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2436:26: - 1300 | - 0.16e2_dp/0.3e1_dp*t207*t139*t142 - (16._dp*t208*t146) - | ^ -Warning: 't208' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1300:72: Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1397:30: + 2436 | t2348 = t176*t907 + | ^ +Warning: 't907' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: - 1397 | t1056 = 0.1e1_dp/t206 - | ^ -Warning: 't206' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1300:72: + 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) + | ^ +Warning: 't904' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2404:26: - 1300 | - 0.16e2_dp/0.3e1_dp*t207*t139*t142 - (16._dp*t208*t146) - | ^ -Warning: 't203' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1300:72: Warning: 't202' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: + 2404 | t2245 = t902*t142 + | ^ +Warning: 't902' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: - 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) - | ^ -Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: + 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) + | ^ +Warning: 't898' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't897' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't893' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: - 1385 | *t902 - t113*t114*t906 - | ^ -Warning: 't197' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: + 2403 | - t553*t77*t1236)/0.2e1_dp) + | ^ +Warning: 't892' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't891' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: - 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) - | ^ -Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: + 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) + | ^ +Warning: 't889' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2388:47: - 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 - | ^ -Warning: 't191' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1377:25: + 2388 | + t1456*t340*t1457*t440) + | ^ +Warning: 't888' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: - 1377 | t874 = t342*t190 - | ^ -Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: + 2403 | - t553*t77*t1236)/0.2e1_dp) + | ^ +Warning: 't885' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't880' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: - 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 - | ^ -Warning: 't189' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: + 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) + | ^ +Warning: 't877' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: - 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) - | ^ -Warning: 't188' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: + 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) + | ^ +Warning: 't876' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't874' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: - 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 - | ^ -Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: + 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) + | ^ +Warning: 't873' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: Warning: 't871' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2377:26: - 1396 | *t114*t321*t909 - | ^ -Warning: 't184' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: + 2377 | t2142 = t870*t507 + | ^ +Warning: 't870' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: - 1305 | (48._dp*t224*t181) - | ^ -Warning: 't181' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: Warning: 't175' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: + 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) + | ^ +Warning: 't867' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't865' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: - 1287 | t12*t61) - | ^ -Warning: 't173' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: + 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) + | ^ +Warning: 't851' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: Warning: 't849' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: - 1305 | (48._dp*t224*t181) - | ^ -Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: + 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) + | ^ +Warning: 't848' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2518:114: - 1287 | t12*t61) - | ^ -Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1305:34: + 2518 | *t68 - 2._dp*t842*t441 + 2._dp*t85*t1265 - t85*t1282) + | ^ +Warning: 't846' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: - 1305 | (48._dp*t224*t181) - | ^ -Warning: 't166' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1288:24: + 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) + | ^ +Warning: 't845' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: Warning: 't842' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2368:68: - 1288 | t508 = t165*t13 - | ^ -Warning: 't165' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: + 2368 | t836 - t80*(t1663 + t1802 + t1898 + t2028)*Clda + | ^ +Warning: 't836' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: - 1287 | t12*t61) - | ^ -Warning: 't159' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: + 2304 | *t1649)*alpha6*t284*t286) + | ^ +Warning: 't832' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: Warning: 't826' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: Warning: 't823' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: Warning: 't820' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: - 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 - | ^ -Warning: 't158' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: + 2494 | *(t444) + | ^ +Warning: 't817' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: - 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 - | ^ -Warning: 't157' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1301:25: + 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 + | ^ +Warning: 't816' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: - 1301 | t543 = t212*t156 - | ^ -Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1324:24: + 2304 | *t1649)*alpha6*t284*t286) + | ^ +Warning: 't815' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: - 1324 | t656 = t31*t154 + 2494 | *(t444) | ^ -Warning: 't154' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1278:33: +Warning: 't812' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: - 1278 | t454 = 0.1e1_dp/t153/t65 - | ^ -Warning: 't153' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: + 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + | ^ +Warning: 't810' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: Warning: 't808' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: - 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 - | ^ -Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: + 2434 | *t84*t1579*t587*t444 + | ^ +Warning: 't804' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2226:93: - 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) - | ^ -Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 2226 | *t784) - (2._dp*t779*t656*t1297) + | ^ +Warning: 't803' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: - 1373 | *t331*t333*t253) - | ^ -Warning: 't149' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 2434 | *t84*t1579*t587*t444 + | ^ +Warning: 't801' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2226:93: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't146' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't142' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1271:25: + 2226 | *t784) - (2._dp*t779*t656*t1297) + | ^ +Warning: 't800' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2226:93: Warning: 't799' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2246:69: - 1271 | t430 = t141*t135 - | ^ -Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: + 2246 | /0.2e1_dp - t166*t1355*t83*t170 + (2._dp*t1294*t801) + | ^ +Warning: 't792' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: - 1276 | /0.3e1_dp*t140*t434 + (20._dp*t22*t438) - | ^ -Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 2434 | *t84*t1579*t587*t444 + | ^ +Warning: 't791' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2246:69: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't139' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1391:132: + 2246 | /0.2e1_dp - t166*t1355*t83*t170 + (2._dp*t1294*t801) + | ^ +Warning: 't787' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: - 1391 | *t389*t315) + t113*t15*t535*t115 - t113*t314*t395 - | ^ -Warning: 't131' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1290:24: + 2434 | *t84*t1579*t587*t444 + | ^ +Warning: 't784' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2246:69: - 1290 | t515 = t42*t130 - | ^ -Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1269:34: + 2246 | /0.2e1_dp - t166*t1355*t83*t170 + (2._dp*t1294*t801) + | ^ +Warning: 't783' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2418:75: - 1269 | t425 = t54*r3*t56*t6*t129 - | ^ -Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 2418 | t2269*t2271) + | ^ +Warning: 't781' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2246:69: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: + 2246 | /0.2e1_dp - t166*t1355*t83*t170 + (2._dp*t1294*t801) + | ^ +Warning: 't780' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2581:32: - 1276 | /0.3e1_dp*t140*t434 + (20._dp*t22*t438) - | ^ -Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 2581 | *(t783)*(t2927) + | ^ +Warning: 't779' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't124' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 2494 | *(t444) + | ^ +Warning: 't772' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2312:26: - 1373 | *t331*t333*t253) - | ^ -Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: + 2312 | t1853 = t771*t275 + | ^ +Warning: 't771' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: - 1438 | + t403*t1066 + t403*t1069) - | ^ -Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: + 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) + | ^ +Warning: 't769' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: - 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 - | ^ -Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1197:22: + 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 + | ^ +Warning: 't765' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: - 1197 | t299 = t93**2 - | ^ -Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 2332 | *(t1176)) - t267*t1731)*alpha5*t271 + | ^ +Warning: 't763' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: - 1373 | *t331*t333*t253) - | ^ -Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1270:27: + 2304 | *t1649)*alpha6*t284*t286) + | ^ +Warning: 't761' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: Warning: 't759' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: - 1270 | t428 = t21/t9/t425 + 2351 | *(t746)*(t753)*(t1318) + | ^ +Warning: 't755' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2164:27: + + 2164 | t1306 = t1305*t754 | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1238:47: +Warning: 't754' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2581:32: - 1238 | t364 = f12*(2._dp*t343*t89 + t79*t361) - | ^ -Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 2581 | *(t783)*(t2927) + | ^ +Warning: 't753' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: - 1373 | *t331*t333*t253) - | ^ -Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: + 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) + | ^ +Warning: 't752' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2450:65: - 1438 | + t403*t1066 + t403*t1069) - | ^ -Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: + 2450 | *t2271 + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2311) + | ^ +Warning: 't748' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: - 1396 | *t114*t321*t909 + 2351 | *(t746)*(t753)*(t1318) + | ^ +Warning: 't747' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: Warning: 't746' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: Warning: 't740' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2581:32: + + 2581 | *(t783)*(t2927) | ^ -Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1399:35: +Warning: 't739' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2443:70: - 1399 | t1066 = t331*t332*t227*t83 - | ^ -Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1234:53: + 2443 | t2363*t2305 + 0.5e1_dp/0.2e1_dp*(t735)*(t739)*(t2059) + | ^ +Warning: 't736' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: - 1234 | t352 = 2._dp*t343*t81 + t79*t347 - t113*t350 - | ^ -Warning: 't81' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: + 2351 | *(t746)*(t753)*(t1318) + | ^ +Warning: 't735' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: - 1396 | *t114*t321*t909 - | ^ -Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 2332 | *(t1176)) - t267*t1731)*alpha5*t271 + | ^ +Warning: 't728' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2481:26: - 1373 | *t331*t333*t253) - | ^ -Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1339:23: + 2481 | t2529 = t721*t444 + | ^ +Warning: 't721' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: - 1339 | t811 = t78*t16 - | ^ -Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1439:62: + 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) + | ^ +Warning: 't718' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: Warning: 't717' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: Warning: 't713' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: - 1439 | e_ndrho_ndrho = e_ndrho_ndrho + (-t76*t1205*Clda)*sx0 - | ^ -Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1320:22: + 2332 | *(t1176)) - t267*t1731)*alpha5*t271 + | ^ +Warning: 't711' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2284:69: - 1320 | t633 = t74**2 - | ^ -Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: + 2284 | - 0.3e1_dp/0.4e1_dp*t280*t1723 + t280*t1726/0.2e1_dp + | ^ +Warning: 't701' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2458:26: - 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 - | ^ -Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: + 2458 | t2437 = t698*t444 + | ^ +Warning: 't698' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2284:69: - 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) - | ^ -Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 2284 | - 0.3e1_dp/0.4e1_dp*t280*t1723 + t280*t1726/0.2e1_dp + | ^ +Warning: 't697' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2284:69: Warning: 't691' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2352:35: - 1373 | *t331*t333*t253) - | ^ -Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1418:24: + 2352 | t1983 = 0.1e1_dp/t224/t690 + | ^ +Warning: 't690' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2270:26: - 1418 | t1080 = t69*t13 + 2270 | t1686 = t689*t257 + | ^ +Warning: 't689' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + + 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + | ^ +Warning: 't685' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + + 2494 | *(t444) | ^ -Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1298:53: +Warning: 't681' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: - 1298 | t193 + 0.6e1_dp*t68*t69*t520*t71 - | ^ -Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: + 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + | ^ +Warning: 't679' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: Warning: 't673' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: - 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 - | ^ -Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1162:25: + 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) + | ^ +Warning: 't669' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: - 1162 | t231 = t66*ndrho - | ^ -Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 2494 | *(t444) + | ^ +Warning: 't663' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: - 1373 | *t331*t333*t253) - | ^ -Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1316:30: + 2514 | *t156*t444 + | ^ +Warning: 't659' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: - 1316 | a5*t18*t52*t63 - | ^ -Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: + 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 + | ^ +Warning: 't658' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: - 1287 | t12*t61) - | ^ -Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1131:31: + 2304 | *t1649)*alpha6*t284*t286) + | ^ +Warning: 't657' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: - 1131 | t181 = t58/t59/rho*t61 - | ^ -Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: + 2514 | *t156*t444 + | ^ +Warning: 't656' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: - 1287 | t12*t61) - | ^ -Warning: 't53' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: + 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + | ^ +Warning: 't653' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: - 1276 | /0.3e1_dp*t140*t434 + (20._dp*t22*t438) + 2514 | *t156*t444 + | ^ +Warning: 't645' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2318:26: + + 2318 | t1885 = t644*t223 + | ^ +Warning: 't644' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + + 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ -Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1316:30: +Warning: 't639' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2468:44: - 1316 | a5*t18*t52*t63 + 2468 | t2449 + t280*t2452/0.2e1_dp + | ^ +Warning: 't638' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: + + 2479 | *t620*(t1240) | ^ -Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: +Warning: 't631' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: - 1287 | t12*t61) - | ^ -Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1272:26: + 2332 | *(t1176)) - t267*t1731)*alpha5*t271 + | ^ +Warning: 't629' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: - 1272 | t434 = t44*t28*t7 - | ^ -Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1290:24: + 2479 | *t620*(t1240) + | ^ +Warning: 't626' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: - 1290 | t515 = t42*t130 - | ^ -Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: + 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) + | ^ +Warning: 't624' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: - 1287 | t12*t61) - | ^ -Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1158:26: + 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 + | ^ +Warning: 't621' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2482:26: - 1158 | t224 = a5*t36*t52 + 2482 | t2543 = t908*t620 | ^ -Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: +Warning: 't620' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: - 1287 | t12*t61) - | ^ -Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1281:32: + 2514 | *t156*t444 + | ^ +Warning: 't617' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: - 1281 | t465 = t32*t154*t78*t42 - | ^ -Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1396:32: + 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) + | ^ +Warning: 't613' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: - 1396 | *t114*t321*t909 - | ^ -Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: + 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) + | ^ +Warning: 't603' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2539:27: - 1438 | + t403*t1066 + t403*t1069) - | ^ -Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1273:28: + 2539 | t2841 = t602*t1285 + | ^ +Warning: 't602' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: - 1273 | t438 = t24*t173*t28 - | ^ -Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1292:23: + 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + | ^ +Warning: 't597' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2354:26: - 1292 | t520 = t26*t15 - | ^ -Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1287:49: + 2354 | t1988 = t596*t199 + | ^ +Warning: 't596' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: - 1287 | t12*t61) - | ^ -Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1273:28: + 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + | ^ +Warning: 't592' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: - 1273 | t438 = t24*t173*t28 - | ^ -Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: + 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 + | ^ +Warning: 't589' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: - 1276 | /0.3e1_dp*t140*t434 + (20._dp*t22*t438) - | ^ -Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1276:55: Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1316:30: + 2479 | *t620*(t1240) + | ^ +Warning: 't588' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: - 1316 | a5*t18*t52*t63 + 2494 | *(t444) + | ^ +Warning: 't587' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: + + 2479 | *t620*(t1240) | ^ -Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1312:122: +Warning: 't583' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: - 1312 | *t199) + (2._dp*t157*t131*t228) - (4._dp*t232*t199) - | ^ -Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1415:132: + 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) + | ^ +Warning: 't582' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2424:32: - 1415 | *t335 - t848*t1062 + t329*t1066 + t329*t1069)) - | ^ -Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1319:63: + 2424 | t2305 = t581*t168*t2072 + | ^ +Warning: 't581' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: - 1319 | *t158*t624 + 2._dp*t32*t66*t4*t14*t158 - | ^ -Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1418:24: + 2514 | *t156*t444 + | ^ +Warning: 't578' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: Warning: 't576' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2335:26: - 1418 | t1080 = t69*t13 - | ^ -Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1375:54: + 2335 | t1923 = t176*t575 + | ^ +Warning: 't575' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2407:50: - 1375 | - t76*t865*Clda)*sx0 - | ^ -Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 2407 | 0.7e1_dp/0.2e1_dp*t569*t571*t1240 + | ^ +Warning: 't572' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2407:50: Warning: 't571' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2407:50: Warning: 't569' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2201:26: - 1373 | *t331*t333*t253) - | ^ -Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: + 2201 | t1520 = t567*t142 + | ^ +Warning: 't567' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: - 1429 | *t114*t820*t1076 - t113*t114*t321*t1101 - | ^ -Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1429:56: Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1332:30: + 2403 | - t553*t77*t1236)/0.2e1_dp) + | ^ +Warning: 't563' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't562' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't558' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: - 1332 | t113*t114*t678 - | ^ -Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1385:38: + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ +Warning: 't557' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: - 1385 | *t902 - t113*t114*t906 - | ^ -Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1229:24: + 2403 | - t553*t77*t1236)/0.2e1_dp) + | ^ +Warning: 't556' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't554' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: - 1229 | t343 = t342*t11 - | ^ -Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: + 2142 | *t1220 - t375*t340*t1237 + | ^ +Warning: 't553' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: - 1438 | + t403*t1066 + t403*t1069) - | ^ -Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ +Warning: 't552' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't551' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't550' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't542' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't540' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't539' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2195:31: - 1373 | *t331*t333*t253) - | ^ -Warning: 't107' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1438:81: + 2195 | t1478 = t125*t538*t129 + | ^ +Warning: 't538' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: - 1438 | + t403*t1066 + t403*t1069) - | ^ -Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ +Warning: 't537' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2388:47: - 1373 | *t331*t333*t253) - | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1373:132: Warning: 't100' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1217:22: + 2388 | + t1456*t340*t1457*t440) + | ^ +Warning: 't535' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: - 1217 | t328 = t3*t10 - | ^ -Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1148:24: + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ +Warning: 't534' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't533' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't531' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2190:30: - 1148 | t206 = t1*ndrho + 2190 | t1442 = t96*t115*t525 + | ^ +Warning: 't525' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: + + 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) + | ^ +Warning: 't522' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: Warning: 't518' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2091:24: + + 2091 | t1086 = t4*t515 | ^ -Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5635:90: +Warning: 't515' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: - 5635 | 1.0_dp/Q*(dQrho*dQndrho + d2Qrhondrho) + 1.0_dp/(Q*Q)*dQrho*dQndrho - | ^ -Warning: 'dqrho' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:362:76: + 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 + | ^ +Warning: 't514' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: - 362 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & - | ^ -note: 'dqrho' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: + 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) + | ^ +Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: Warning: 't511' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: - 885 | *t71*t678)/0.2e1_dp) - | ^ -Warning: 'dqndrho' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:912:88: + 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 + | ^ +Warning: 't510' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: - 912 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t269*t520 - t76*t1369*Clda)*sx0 - | ^ -Warning: 't520' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: + 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) + | ^ +Warning: 't509' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: - 948 | *t1365)) - | ^ -Warning: 't515' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't514' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: + 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 + | ^ +Warning: 't508' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2377:26: - 929 | *t148*t983*t1372 - t147*t148*t404*t1395 - | ^ -Warning: 't511' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: Warning: 't510' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: Warning: 't508' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: Warning: 't507' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:919:32: + 2377 | t2142 = t870*t507 + | ^ +Warning: 't507' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: - 919 | t147*t148*t1392 - | ^ + 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 + | ^ Warning: 't504' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:919:32: Warning: 't501' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: - 948 | *t1365)) - | ^ -Warning: 't497' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't495' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't491' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:886:26: + 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) + | ^ +Warning: 't503' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: - 886 | t1263 = t489*t136 - | ^ -Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: + 2403 | - t553*t77*t1236)/0.2e1_dp) + | ^ +Warning: 't499' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: - 948 | *t1365)) - | ^ -Warning: 't485' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't484' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't480' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ +Warning: 't498' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2177:25: - 885 | *t71*t678)/0.2e1_dp) - | ^ + 2177 | t1379 = t495*t82 + | ^ +Warning: 't495' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: + + 2403 | - t553*t77*t1236)/0.2e1_dp) + | ^ +Warning: 't493' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't486' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't481' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: + + 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) + | ^ Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2176:132: - 948 | *t1365)) + 2176 | (F2*t1126*t68 - 2._dp*t475*t402 + 2._dp*t85*t1136 - t85*t1169)) | ^ -Warning: 't476' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:870:45: +Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: - 870 | + t888*t148*t889*t261) - | ^ + 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) + | ^ Warning: 't475' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: Warning: 't472' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: Warning: 't469' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2176:132: - 885 | *t71*t678)/0.2e1_dp) + 2176 | (F2*t1126*t68 - 2._dp*t475*t402 + 2._dp*t85*t1136 - t85*t1169)) | ^ -Warning: 't472' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: +Warning: 't468' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: - 948 | *t1365)) - | ^ + 2494 | *(t444) + | ^ Warning: 't465' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't463' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't449' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't447' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't446' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:921:112: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: - 921 | t66 - 2._dp*t440*t432 + 2._dp*t86*t1388 - t86*t1392) - | ^ -Warning: 't444' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: + 2304 | *t1649)*alpha6*t284*t286) + | ^ +Warning: 't463' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: - 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) - | ^ -Warning: 't443' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: Warning: 't440' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: + 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + | ^ +Warning: 't457' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: - 948 | *t1365)) - | ^ -Warning: 't435' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:919:32: + 2514 | *t156*t444 + | ^ +Warning: 't454' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: Warning: 't453' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: - 919 | t147*t148*t1392 - | ^ -Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:921:112: + 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + | ^ +Warning: 't452' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: - 921 | t66 - 2._dp*t440*t432 + 2._dp*t86*t1388 - t86*t1392) - | ^ -Warning: 't432' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:919:32: + 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 + | ^ +Warning: 't449' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2516:86: - 919 | t147*t148*t1392 - | ^ -Warning: 't430' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: + 2516 | + t2688)*Clda + | ^ +Warning: 't446' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2418:75: - 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 - | ^ -Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: + 2418 | t2269*t2271) + | ^ +Warning: 't444' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2155:34: - 862 | - t147*t148*t1114 + 2155 | - t375*t340*t1282 + | ^ +Warning: 't442' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2518:114: + + 2518 | *t68 - 2._dp*t842*t441 + 2._dp*t85*t1265 - t85*t1282) + | ^ +Warning: 't441' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2388:47: + + 2388 | + t1456*t340*t1457*t440) + | ^ +Warning: 't440' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: + + 2135 | - (48._dp*t437*t398) + | ^ +Warning: 't437' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: 't432' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2155:34: + + 2155 | - t375*t340*t1282 | ^ Warning: 't426' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:853:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: - 853 | t1082 = t425*t224 - | ^ + 2142 | *t1220 - t375*t340*t1237 + | ^ Warning: 't425' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:851:55: - - 851 | - t76*t1073*Clda)*sx0 - | ^ -Warning: 't423' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2389:26: - 948 | *t1365)) - | ^ -Warning: 't418' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: + 2389 | t2224 = t424*t377 + | ^ +Warning: 't424' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't416' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:900:35: + 2129 | - 0.16e2_dp/0.3e1_dp*t420*t361*t364 - (16._dp*t421*t368) + | ^ +Warning: 't421' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: Warning: 't420' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: - 900 | t1362 = t414*t415*t261*t83 - | ^ -Warning: 't415' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: + 2151 | *a5*t21*t54*t65 + | ^ +Warning: 't419' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't414' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't413' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: + 2129 | - 0.16e2_dp/0.3e1_dp*t420*t361*t364 - (16._dp*t421*t368) + | ^ +Warning: 't416' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: Warning: 't415' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: - 911 | + t412*t1362 + t412*t1365)) - | ^ + 2142 | *t1220 - t375*t340*t1237 + | ^ Warning: 't412' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2131:25: - 948 | *t1365)) - | ^ + 2131 | t1214 = t411*t18 + | ^ Warning: 't411' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: - - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't410' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: - 948 | *t1365)) - | ^ + 2514 | *t156*t444 + | ^ Warning: 't409' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: - - 911 | + t412*t1362 + t412*t1365)) - | ^ -Warning: 't408' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: - 897 | *t148*t404*t1117 - | ^ + 2494 | *(t444) + | ^ Warning: 't406' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:818:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: - 818 | *(t628)*(t391) + (4._dp*t394*t406) - | ^ -Warning: 't404' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: + 2142 | *t1220 - t375*t340*t1237 + | ^ +Warning: 't403' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: - 897 | *t148*t404*t1117 - | ^ + 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) + | ^ Warning: 't402' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:818:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: - 818 | *(t628)*(t391) + (4._dp*t394*t406) - | ^ -Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ +Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: - 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 - | ^ + 2135 | - (48._dp*t437*t398) + | ^ Warning: 't398' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:776:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: 't392' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: - 776 | *t148*t788 - | ^ -Warning: 't397' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: + 2118 | *t63) + | ^ +Warning: 't390' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: - 862 | - t147*t148*t1114 - | ^ -Warning: 't394' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: + 2135 | - (48._dp*t437*t398) + | ^ +Warning: 't386' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: - 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 - | ^ -Warning: 't391' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: Warning: 't390' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: + 2118 | *t63) + | ^ +Warning: 't385' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: - 862 | - t147*t148*t1114 - | ^ -Warning: 't388' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: + 2135 | - (48._dp*t437*t398) + | ^ +Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: - 911 | + t412*t1362 + t412*t1365)) - | ^ -Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: + 2118 | *t63) + | ^ +Warning: 't378' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2389:26: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: + 2389 | t2224 = t424*t377 + | ^ +Warning: 't377' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2110:34: - 911 | + t412*t1362 + t412*t1365)) - | ^ -Warning: 't381' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: Warning: 't377' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: Warning: 't374' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:799:25: + 2110 | t1134 = 0.1e1_dp/t376/t67 + | ^ +Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2120:32: - 799 | t952 = t372*t136 - | ^ + 2120 | t1171 = t375*t340*t1169 + | ^ +Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: + + 2142 | *t1220 - t375*t340*t1237 + | ^ +Warning: 't373' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2096:36: + + 2096 | t1097 = 4._dp*t11*t348*t372 + | ^ Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2199:26: - 885 | *t71*t678)/0.2e1_dp) - | ^ + 2199 | t1498 = t371*t377 + | ^ +Warning: 't371' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: + + 2135 | - (48._dp*t437*t398) + | ^ Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: 't367' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: 't363' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: 't364' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2100:26: - 849 | + (t412)*t414*t416*(t287)) - | ^ + 2100 | t1115 = t363*t312 + | ^ +Warning: 't363' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: + + 2106 | *t25*t1123) + | ^ Warning: 't362' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: - 885 | *t71*t678)/0.2e1_dp) - | ^ + 2135 | - (48._dp*t437*t398) + | ^ Warning: 't361' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: 't359' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: - 897 | *t148*t404*t1117 - | ^ + 2129 | - 0.16e2_dp/0.3e1_dp*t420*t361*t364 - (16._dp*t421*t368) + | ^ Warning: 't358' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: - 849 | + (t412)*t414*t416*(t287)) - | ^ + 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) + | ^ Warning: 't357' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't356' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't355' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't345' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't344' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:793:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: - 793 | t910 = t119*t343*t123 - | ^ -Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: + 2129 | - 0.16e2_dp/0.3e1_dp*t420*t361*t364 - (16._dp*t421*t368) + | ^ +Warning: 't354' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:870:45: + 2106 | *t25*t1123) + | ^ +Warning: 't353' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: - 870 | + t888*t148*t889*t261) - | ^ + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ +Warning: 't352' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: + + 2142 | *t1220 - t375*t340*t1237 + | ^ +Warning: 't349' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ +Warning: 't348' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: + + 2118 | *t63) + | ^ +Warning: 't346' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: + + 2142 | *t1220 - t375*t340*t1237 + | ^ +Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2113:38: + + 2113 | t1139 = 2._dp*t375*t340*t1136 + | ^ Warning: 't340' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: - 849 | + (t412)*t414*t416*(t287)) - | ^ + 2142 | *t1220 - t375*t340*t1237 + | ^ Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't338' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't336' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2125:26: - 885 | *t71*t678)/0.2e1_dp) - | ^ -Warning: 't327' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: + 2125 | t1178 = t411*t338 + | ^ +Warning: 't338' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2516:86: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:782:24: + 2516 | + t2688)*Clda + | ^ +Warning: 't1069' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: - 782 | t854 = t323*t83 + 2494 | *(t444) | ^ -Warning: 't323' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: +Warning: 't1066' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: - 885 | *t71*t678)/0.2e1_dp) - | ^ -Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: 't314' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: + 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 + | ^ +Warning: 't1052' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: Warning: 't1035' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: - 911 | + t412*t1362 + t412*t1365)) - | ^ -Warning: 't307' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: + 2494 | *(t444) + | ^ +Warning: 't1024' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't306' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: + 2479 | *t620*(t1240) + | ^ +Warning: 't1009' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: Warning: 't1001' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2450:65: - 911 | + t412*t1362 + t412*t1365)) - | ^ -Warning: 't304' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: + 2450 | *t2271 + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2311) + | ^ +Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: - 885 | *t71*t678)/0.2e1_dp) - | ^ -Warning: 't303' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: + 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) + | ^ +Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: - 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) - | ^ -Warning: 't301' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:780:132: + 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) + | ^ +Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: - 780 | *t553*t66 - 2._dp*t297*t284 + 2._dp*t86*t784 - t86*t788)) - | ^ -Warning: 't300' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ +Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: - 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) - | ^ -Warning: 't297' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: Warning: 't294' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: Warning: 't291' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:780:132: + 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + | ^ +Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2340:30: - 780 | *t553*t66 - 2._dp*t297*t284 + 2._dp*t86*t784 - t86*t788)) - | ^ -Warning: 't290' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: + 2340 | t1961 = t180*t90*t149 + | ^ +Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: - 897 | *t148*t404*t1117 - | ^ -Warning: 't288' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: + 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + | ^ +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2006:41: - 911 | + t412*t1362 + t412*t1365)) + 2006 | t848 = 2._dp*t412*t88 + t11*t846 + | ^ +Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2176:132: + + 2176 | (F2*t1126*t68 - 2._dp*t475*t402 + 2._dp*t85*t1136 - t85*t1169)) | ^ -Warning: 't287' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: +Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2518:114: - 862 | - t147*t148*t1114 - | ^ -Warning: 't285' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: + 2518 | *t68 - 2._dp*t842*t441 + 2._dp*t85*t1265 - t85*t1282) + | ^ +Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: - 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) - | ^ -Warning: 't284' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: + 2434 | *t84*t1579*t587*t444 + | ^ +Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: - 862 | - t147*t148*t1114 - | ^ -Warning: 't282' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:818:51: + 2587 | t159 + (2._dp*t2267*t916) + (5._dp*t2267*t919) + | ^ +Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1836:24: - 818 | *(t628)*(t391) + (4._dp*t394*t406) - | ^ -Warning: 't281' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: + 1836 | t486 = t82*t453 + | ^ +Warning: 't82' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2612:65: - 862 | - t147*t148*t1114 - | ^ -Warning: 't278' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: Warning: 't275' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: Warning: 't274' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: Warning: 't272' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:912:88: + 2612 | e_ndrho_ndrho = e_ndrho_ndrho - t80*(t2963 + t3167)*Clda + | ^ +Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: - 912 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t269*t520 - t76*t1369*Clda)*sx0 - | ^ -Warning: 't269' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: + 2304 | *t1649)*alpha6*t284*t286) + | ^ +Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2157:23: - 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) - | ^ -Warning: 't266' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: + 2157 | t1287 = t78**2 + | ^ +Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2459:30: - 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 - | ^ -Warning: 't265' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: Warning: 't263' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: + 2459 | t2442 = t75*t409*t444 + | ^ +Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2123:71: - 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) - | ^ -Warning: 't262' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:870:45: + 2123 | - t1132 + t1139 - t1171 + 0.10e2_dp/0.9e1_dp*t73*t1173 + | ^ +Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: - 870 | + t888*t148*t889*t261) - | ^ -Warning: 't261' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: + 2494 | *(t444) + | ^ +Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1817:53: - 749 | (48._dp*t258*t215) - | ^ -Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: 't254' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: 't253' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: 't249' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: + 1817 | t444 = 2._dp*t412*t70 + t11*t426 - t375*t442 + | ^ +Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2095:36: - 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) - | ^ -Warning: 't247' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:744:25: + 2095 | t1094 = 6._dp*t11*t1091*t69 + | ^ +Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2016:25: - 744 | t655 = t246*t190 + 2016 | t876 = t68*ndrho | ^ -Warning: 't246' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:899:33: +Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1781:22: - 899 | t1358 = t1059*t1060*t245 - | ^ -Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: + 1781 | t376 = t67**2 + | ^ +Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: - 743 | - 0.16e2_dp/0.3e1_dp*t241*t173*t176 - (16._dp*t242*t180) - | ^ -Warning: 't242' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:898:30: + 2151 | *a5*t21*t54*t65 + | ^ +Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: - 898 | t1352 = 0.1e1_dp/t240 - | ^ -Warning: 't240' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: + 2118 | *t63) + | ^ +Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1790:31: - 743 | - 0.16e2_dp/0.3e1_dp*t241*t173*t176 - (16._dp*t242*t180) - | ^ -Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: Warning: 't236' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: + 1790 | t398 = t60/t61/rho*t63 + | ^ +Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: - 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) - | ^ -Warning: 't233' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: + 2118 | *t63) + | ^ +Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: - 862 | - t147*t148*t1114 - | ^ -Warning: 't231' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: + 2151 | *a5*t21*t54*t65 + | ^ +Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: - 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) - | ^ -Warning: 't228' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: + 2118 | *t63) + | ^ +Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2101:27: - 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 - | ^ -Warning: 't225' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:853:26: + 2101 | t1119 = t46*t31*t6 + | ^ +Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: - 853 | t1082 = t425*t224 - | ^ -Warning: 't224' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: + 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + | ^ +Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: - 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 - | ^ -Warning: 't223' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: + 2118 | *t63) + | ^ +Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2182:33: - 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) - | ^ -Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: + 2182 | t1409 = t116*t377*t4*t44 + | ^ +Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: - 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 - | ^ -Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: + 2118 | *t63) + | ^ +Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1813:26: - 897 | *t148*t404*t1117 - | ^ -Warning: 't218' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: + 1813 | t437 = a5*t38*t54 + | ^ +Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: - 749 | (48._dp*t258*t215) - | ^ -Warning: 't215' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: 't209' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: + 2118 | *t63) + | ^ +Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2200:26: - 730 | t12*t61) - | ^ -Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: + 2200 | t1501 = t34*t1134 + | ^ +Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2368:68: - 749 | (48._dp*t258*t215) - | ^ -Warning: 't203' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: + 2368 | t836 - t80*(t1663 + t1802 + t1898 + t2028)*Clda + | ^ +Warning: 't336' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: - 730 | t12*t61) - | ^ -Warning: 't202' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: Warning: 't201' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: + 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) + | ^ +Warning: 't333' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: - 749 | (48._dp*t258*t215) - | ^ -Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:731:24: + 2332 | *(t1176)) - t267*t1731)*alpha5*t271 + | ^ +Warning: 't332' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: - 731 | t620 = t199*t13 + 2494 | *(t444) | ^ -Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: +Warning: 't330' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1824:25: - 730 | t12*t61) - | ^ -Warning: 't193' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: + 1824 | t457 = t329*t330 + | ^ +Warning: 't329' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: - 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 - | ^ -Warning: 't192' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: + 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) + | ^ +Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: - 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 - | ^ -Warning: 't191' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:744:25: + 2151 | *a5*t21*t54*t65 + | ^ +Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: - 744 | t655 = t246*t190 - | ^ -Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:871:26: + 2304 | *t1649)*alpha6*t284*t286) + | ^ +Warning: 't319' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: - 871 | t1242 = t245*t188 - | ^ -Warning: 't188' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:721:33: + 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) + | ^ +Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: - 721 | t566 = 0.1e1_dp/t187/t65 - | ^ -Warning: 't187' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ +Warning: 't315' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: - 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 - | ^ -Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: + 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 + | ^ +Warning: 't311' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1963:25: - 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) - | ^ -Warning: 't184' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: + 1963 | t761 = t310*t311 + | ^ +Warning: 't310' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2102:29: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't183' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: + 2102 | t1123 = t27*t390*t31 + | ^ +Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2272:38: - 749 | (48._dp*t258*t215) - | ^ -Warning: 't180' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:713:25: + 2272 | t1697 = f2732/t295/t1693/t250 + | ^ +Warning: 't295' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2253:25: - 713 | t542 = t175*t169 + 2253 | t1633 = f94/t294 | ^ -Warning: 't175' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: +Warning: 't294' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: - 719 | *t550) - | ^ -Warning: 't174' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:749:34: + 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) + | ^ +Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2267:41: - 749 | (48._dp*t258*t215) + 2267 | t1680 = 0.1e1_dp/t290/t1677/t690 + | ^ +Warning: 't290' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: + + 2304 | *t1649)*alpha6*t284*t286) + | ^ +Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1934:34: + + 1934 | t689 = 0.1e1_dp/t290/t289 | ^ -Warning: 't173' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: +Warning: 't289' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't172' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: + 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) + | ^ +Warning: 't286' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: - 743 | - 0.16e2_dp/0.3e1_dp*t241*t173*t176 - (16._dp*t242*t180) - | ^ -Warning: 't166' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:892:72: + 2304 | *t1649)*alpha6*t284*t286) + | ^ +Warning: 't285' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: - 892 | (2._dp*t501*t398) + t147*t15*t647*t149 - t147*t397*t507 - | ^ -Warning: 't165' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: + 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) + | ^ +Warning: 't284' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2289:32: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't164' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:711:34: + 2289 | t1770 = t1767*t1768*t28 + | ^ +Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: - 711 | t537 = t54*r3*t56*t6*t163 - | ^ -Warning: 't163' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:743:72: + 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) + | ^ +Warning: 't276' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: - 743 | - 0.16e2_dp/0.3e1_dp*t241*t173*t176 - (16._dp*t242*t180) - | ^ -Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: + 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) + | ^ +Warning: 't275' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2311:25: - 719 | *t550) - | ^ -Warning: 't159' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: + 2311 | t1846 = t75*t273 + | ^ +Warning: 't273' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't158' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: + 2514 | *t156*t444 + | ^ +Warning: 't271' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1988:25: - 948 | *t1365)) - | ^ -Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: + 1988 | t815 = t270*t193 + | ^ +Warning: 't270' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: - 929 | *t148*t983*t1372 - t147*t148*t404*t1395 - | ^ -Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: + 2403 | - t553*t77*t1236)/0.2e1_dp) + | ^ +Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2316:41: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:712:27: + 2316 | t1880 = 0.1e1_dp/t258/t1677/t222 + | ^ +Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2468:44: - 712 | t540 = t21/t9/t537 + 2468 | t2449 + t280*t2452/0.2e1_dp + | ^ +Warning: 't257' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: + + 2514 | *t156*t444 | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:674:41: +Warning: 't256' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2273:40: - 674 | t446 = 2._dp*t426*t89 + t79*t444 - | ^ -Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:780:132: + 2273 | t1709 = 0.1e1_dp/t252/t293/t250 + | ^ +Warning: 't252' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2284:69: - 780 | *t553*t66 - 2._dp*t297*t284 + 2._dp*t86*t784 - t86*t788)) - | ^ -Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:921:112: + 2284 | - 0.3e1_dp/0.4e1_dp*t280*t1723 + t280*t1726/0.2e1_dp + | ^ +Warning: 't251' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: - 921 | t66 - 2._dp*t440*t432 + 2._dp*t86*t1388 - t86*t1392) - | ^ -Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: + 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) + | ^ +Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: - 897 | *t148*t404*t1117 - | ^ -Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: + 2106 | *t25*t1123) + | ^ +Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: - 948 | *t1365)) - | ^ -Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:670:53: + 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) + | ^ +Warning: 't247' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1909:25: - 670 | t435 = 2._dp*t426*t81 + t79*t430 - t147*t433 - | ^ -Warning: 't81' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:897:33: + 1909 | t629 = t246*t192 + | ^ +Warning: 't246' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: - 897 | *t148*t404*t1117 - | ^ -Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:776:26: + 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) + | ^ +Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: Warning: 't239' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: - 776 | *t148*t788 - | ^ -Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:807:24: + 2304 | *t1649)*alpha6*t284*t286) + | ^ +Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2276:35: - 807 | t1023 = t78*t16 - | ^ -Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:949:62: + 2276 | t1722 = 0.1e1_dp/t227/t250 + | ^ +Warning: 't227' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2352:35: - 949 | e_ndrho_ndrho = e_ndrho_ndrho + (-t76*t1561*Clda)*sx0 - | ^ -Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:764:22: + 2352 | t1983 = 0.1e1_dp/t224/t690 + | ^ +Warning: 't224' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: - 764 | t744 = t74**2 - | ^ -Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: + 2514 | *t156*t444 + | ^ +Warning: 't223' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1935:25: - 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 - | ^ -Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: + 1935 | t690 = t256*t222 + | ^ +Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: - 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) - | ^ -Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:776:26: + 2106 | *t25*t1123) + | ^ +Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1896:24: - 776 | *t148*t788 + 1896 | t592 = t219*t72 + | ^ +Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + + 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) + | ^ +Warning: 't214' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1907:26: + + 1907 | t624 = t213*omega | ^ -Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:870:45: +Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: - 870 | + t888*t148*t889*t261) - | ^ -Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:741:53: + 2151 | *a5*t21*t54*t65 + | ^ +Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1930:29: - 741 | t227 + 0.6e1_dp*t68*t69*t632*t71 - | ^ -Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: + 1930 | t673 = t97/t205/t199 + | ^ +Warning: 't205' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: - 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 - | ^ -Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:572:25: + 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) + | ^ +Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: - 572 | t265 = t66*ndrho - | ^ -Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:658:24: + 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) + | ^ +Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: - 658 | t416 = t415*t65 + 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + | ^ +Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + + 2494 | *(t444) | ^ -Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:760:30: +Warning: 't193' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: - 760 | a5*t18*t52*t63 + 2479 | *t620*(t1240) | ^ -Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: +Warning: 't192' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: - 730 | t12*t61) - | ^ -Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:541:31: + 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) + | ^ +Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: - 541 | t215 = t58/t59/rho*t61 - | ^ -Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: + 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) + | ^ +Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: - 730 | t12*t61) - | ^ -Warning: 't53' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: + 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) + | ^ +Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: - 719 | *t550) - | ^ -Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:760:30: + 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) + | ^ +Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2162:26: - 760 | a5*t18*t52*t63 - | ^ -Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: + 2162 | t1304 = t166*t181 + | ^ +Warning: 't181' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: - 730 | t12*t61) - | ^ -Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:714:26: + 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) + | ^ +Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2437:26: - 714 | t546 = t44*t28*t7 + 2437 | t2363 = t176*t177 | ^ -Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:733:24: +Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: - 733 | t627 = t42*t164 - | ^ -Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: + 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + | ^ +Warning: 't174' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: - 730 | t12*t61) - | ^ -Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:568:26: + 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) + | ^ +Warning: 't170' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: - 568 | t258 = a5*t36*t52 - | ^ -Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: + 2106 | *t25*t1123) + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2170:40: - 730 | t12*t61) - | ^ -Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:724:32: + 2170 | t1324 = 0.1e1_dp/t169/t156/t155 + | ^ +Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: - 724 | t577 = t32*t188*t78*t42 - | ^ -Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:821:23: + 2494 | *(t444) + | ^ +Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2410:26: - 821 | t1057 = t31**2 - | ^ -Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:760:30: + 2410 | t2269 = t166*t167 + | ^ +Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2418:75: + + 2418 | t2269*t2271) + | ^ +Warning: 't163' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2239:35: - 760 | a5*t18*t52*t63 - | ^ -Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:715:28: + 2239 | t1579 = 0.1e1_dp/t162/t155 + | ^ +Warning: 't162' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: - 715 | t550 = t24*t207*t28 - | ^ -Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:735:23: + 2106 | *t25*t1123) + | ^ +Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: - 735 | t632 = t26*t15 - | ^ -Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:730:49: + 2479 | *t620*(t1240) + | ^ +Warning: 't159' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2233:41: - 730 | t12*t61) - | ^ -Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:715:28: + 2233 | t1562 = 0.1e1_dp/t158/t1559/t155 + | ^ +Warning: 't158' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1890:34: - 715 | t550 = t24*t207*t28 - | ^ -Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: + 1890 | t581 = 0.1e1_dp/t158/t157 + | ^ +Warning: 't157' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: - 719 | *t550) - | ^ -Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:719:70: Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:760:30: + 2514 | *t156*t444 + | ^ +Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2422:32: - 760 | a5*t18*t52*t63 - | ^ -Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:756:65: + 2422 | t2291 = t752*t155*t2072 + | ^ +Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2411:32: - 756 | (2._dp*t191*t165*t262) - (4._dp*t266*t233) - | ^ -Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:851:55: + 2411 | t2271 = t752*t154*t2072 + | ^ +Warning: 't154' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: - 851 | - t76*t1073*Clda)*sx0 + 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) | ^ -Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: +Warning: 't153' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2419:26: - 929 | *t148*t983*t1372 - t147*t148*t404*t1395 - | ^ -Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:866:93: + 2419 | t2280 = t151*t152 + | ^ +Warning: 't152' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: - 866 | t432 - t440*t284 + 2._dp*t86*t1110 - t86*t1114) - | ^ + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:929:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: - 929 | *t148*t983*t1372 - t147*t148*t404*t1395 - | ^ + 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) + | ^ Warning: 't149' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:776:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2309:32: - 776 | *t148*t788 - | ^ + 2309 | t1835 = t148*t149*t1562 + | ^ Warning: 't148' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:862:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2336:31: - 862 | - t147*t148*t1114 - | ^ + 2336 | t1932 = t176*t147*t149 + | ^ Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:911:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: - 911 | + t412*t1362 + t412*t1365)) - | ^ -Warning: 't143' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: + 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) + | ^ +Warning: 't145' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1883:25: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't142' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:763:63: + 1883 | t569 = t141*t142 + | ^ +Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: - 763 | *t192*t735 + 2._dp*t32*t66*t4*t14*t192 - | ^ + 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) + | ^ Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: - 948 | *t1365)) - | ^ -Warning: 't139' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:630:25: + 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) + | ^ +Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: - 630 | t374 = t135*t136 - | ^ -Warning: 't135' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: + 2403 | - t553*t77*t1236)/0.2e1_dp) + | ^ +Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: - 948 | *t1365)) - | ^ -Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ +Warning: 't131' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: + 2403 | - t553*t77*t1236)/0.2e1_dp) + | ^ +Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: - 885 | *t71*t678)/0.2e1_dp) - | ^ + 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) + | ^ +Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1870:30: - 849 | + (t412)*t414*t416*(t287)) - | ^ + 1870 | t550 = t125*t126*t128 + | ^ Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:885:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2191:25: - 885 | *t71*t678)/0.2e1_dp) - | ^ + 2191 | t1445 = t96*t124 + | ^ +Warning: 't124' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: + + 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) + | ^ Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:819:25: + 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) + | ^ +Warning: 't120' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1760:23: - 819 | t1055 = t411*t12 - | ^ + 1760 | t346 = t12*rho + | ^ Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:617:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2388:47: - 617 | t355 = t119*t120*t122 - | ^ + 2388 | + t1456*t340*t1457*t440) + | ^ Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:787:24: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: - 787 | t875 = t97*t118 - | ^ + 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 + | ^ Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: - 948 | *t1365)) - | ^ + 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) + | ^ Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:948:132: Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:602:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1840:30: - 602 | t326 = t110/t111/t323 + 1840 | t498 = t109/t110/t495 | ^ -Warning: 't111' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:665:24: +Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2176:132: - 665 | t426 = t425*t11 - | ^ + 2176 | (F2*t1126*t68 - 2._dp*t475*t402 + 2._dp*t85*t1136 - t85*t1169)) + | ^ Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:849:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: - 849 | + (t412)*t414*t416*(t287)) - | ^ -Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:653:22: + 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) + | ^ +Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: - 653 | t411 = t3*t10 - | ^ + 2106 | *t25*t1123) + | ^ Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:558:24: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1803:24: - 558 | t240 = t1*ndrho + 1803 | t419 = t1*ndrho | ^ Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5635:90: +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xwpbe.mod' due to: xc_xwpbe.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathlib.mod mathconstants.mod kinds.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xbecke88.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod cp_array_utils.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88.F xc_xbecke88.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:19:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbecke88.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbecke88.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xbecke88.mod' due to: xc_xbecke88.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod cp_array_utils.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_hcth.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_hcth.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_hcth.F xc_hcth.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:19:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_hcth.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_hcth.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_hcth.mod' due to: xc_hcth.o /build/reproducible-path/cp2k-8.1/src/xc/xc_hcth.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_tpss.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_tpss.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod cp_log_handling.mod kinds.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_tpss.F xc_tpss.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:19:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_tpss.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_tpss.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_tpss.mod' due to: xc_tpss.o /build/reproducible-path/cp2k-8.1/src/xc/xc_tpss.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod cp_log_handling.mod kinds.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xbecke88_lr_adiabatic.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod cp_array_utils.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F xc_xbecke88_lr_adiabatic.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:19:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbecke88_lr_adiabatic.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbecke88_lr_adiabatic.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: - 5635 | 1.0_dp/Q*(dQrho*dQndrho + d2Qrhondrho) + 1.0_dp/(Q*Q)*dQrho*dQndrho - | ^ -Warning: 'dqrho' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4531:76: + 4613 | + 0.3200000000e2_dp*t1055*t3674 + | ^ +Warning: 't997' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3175:30: - 4531 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & - | ^ -note: 'dqrho' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5671:94: + 3175 | t99, t991, t995, t997, xx + | ^ +note: 't997' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5160:54: - 5671 | 1.0_dp/(Q*Q)*(-Q*dQndrho*dQndrho - Q*d2Qndrhondrho + dQndrho*dQndrho) - | ^ -Warning: 'dqndrho' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4531:69: + 5160 | t5487 = 0.2160000000e3_dp*t7*t995*t1652 + | ^ +Warning: 't995' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3175:24: - 4531 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t100, & - | ^ -note: 'dqndrho' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5146:97: + 3175 | t99, t991, t995, t997, xx + | ^ +note: 't995' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: - 5146 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t283*t545 - t80*(t1319 + t1443)*Clda)*sx - | ^ -Warning: 't545' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: + 4613 | + 0.3200000000e2_dp*t1055*t3674 + | ^ +Warning: 't991' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3175:18: - 5176 | *t421*t422*t1533 - | ^ -Warning: 't540' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: Warning: 't539' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5195:132: + 3175 | t99, t991, t995, t997, xx + | ^ +note: 't991' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: - 5195 | *t155*t44*t772) - | ^ -Warning: 't533' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5195:132: Warning: 't530' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: + 5031 | *t105*t5118 + | ^ +Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3175:12: - 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 - | ^ -Warning: 't526' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: + 3175 | t99, t991, t995, t997, xx + | ^ +note: 't99' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: - 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) - | ^ -Warning: 't522' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: Warning: 't519' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: Warning: 't510' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: + 4613 | + 0.3200000000e2_dp*t1055*t3674 + | ^ +Warning: 't987' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:95: - 5145 | *t155*t44*t726 - | ^ -Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5182:80: + 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + | ^ +note: 't987' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: - 5182 | *t367*t405*t1552) - | ^ -Warning: 't501' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5102:26: + 4603 | *t3339 + | ^ +Warning: 't984' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:89: - 5102 | t1288 = t864*t500 - | ^ -Warning: 't500' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5182:80: + 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + | ^ +note: 't984' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 5182 | *t367*t405*t1552) - | ^ -Warning: 't498' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't980' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:77: - 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) - | ^ -Warning: 't487' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5076:26: + 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + | ^ +note: 't980' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5190:50: - 5076 | t1181 = t931*t486 - | ^ -Warning: 't486' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: + 5190 | t5564 = 0.1173333333e3_dp*t5060*t98 + | ^ +Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:71: - 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) - | ^ -Warning: 't484' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: + 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + | ^ +note: 't98' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: - 5176 | *t421*t422*t1533 + 4637 | *t339*t969 | ^ -Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5120:26: - - 5120 | t1351 = t476*t420 - | ^ -Warning: 't476' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5121:26: +Warning: 't976' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:60: - 5121 | t1382 = t136*t475 - | ^ -Warning: 't475' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5151:90: + 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + | ^ +note: 't976' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: - 5151 | *t19 + 12._dp*g3*t1*t24*t32) - | ^ -Warning: 't473' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: + 4629 | *t321*t953*t1625 + | ^ +Warning: 't974' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:48: - 5073 | - (16._dp*t469*t203)) - | ^ -Warning: 't472' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: 't469' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: 't468' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: 't465' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: 't464' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: + 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + | ^ +note: 't974' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: - 5176 | *t421*t422*t1533 + 4637 | *t339*t969 | ^ -Warning: 't459' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: Warning: 't457' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5129:26: - - 5129 | t1413 = t140*t456 - | ^ -Warning: 't456' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: - - 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) - | ^ -Warning: 't454' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: - - 5096 | - t450*t239 + 2._dp*t85*t706 - t85*t723) - | ^ -Warning: 't453' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: Warning: 't450' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5068:64: - - 5068 | - t80*(t1074 + t1118)*Clda)*sx - | ^ -Warning: 't444' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: +Warning: 't973' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:42: - 5145 | *t155*t44*t726 - | ^ -Warning: 't439' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: + 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + | ^ +note: 't973' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3510:30: - 5176 | *t421*t422*t1533 - | ^ -Warning: 't438' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5042:27: + 3510 | t627 = t97*t132 + | ^ +Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:30: - 5042 | t1049 = t437*t1048 - | ^ -Warning: 't437' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: + 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + | ^ +note: 't97' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: - 5176 | *t421*t422*t1533 + 4637 | *t339*t969 | ^ -Warning: 't435' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: Warning: 't434' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5039:30: +Warning: 't969' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:25: - 5039 | t1040 = t75/t433/t160 - | ^ -Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: + 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + | ^ +note: 't969' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 - | ^ -Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: Warning: 't427' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't966' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:19: - 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) - | ^ -Warning: 't426' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: + 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + | ^ +note: 't966' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: - 5145 | *t155*t44*t726 - | ^ -Warning: 't423' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: Warning: 't422' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: + 4603 | *t3339 + | ^ +Warning: 't963' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:13: - 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) - | ^ -Warning: 't421' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: + 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + | ^ +note: 't963' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: - 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) - | ^ -Warning: 't420' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: + 4637 | *t339*t969 + | ^ +Warning: 't962' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:92: - 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 - | ^ -Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: + 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + | ^ +note: 't962' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: - 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) - | ^ -Warning: 't415' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: + 4603 | *t3339 + | ^ +Warning: 't959' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:86: - 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 - | ^ -Warning: 't412' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: + 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + | ^ +note: 't959' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) - | ^ -Warning: 't410' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't955' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:74: - 5034 | *(t872) - | ^ -Warning: 't406' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5182:80: + 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + | ^ +note: 't955' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5201:56: - 5182 | *t367*t405*t1552) - | ^ -Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5135:58: + 5201 | t5593 = 0.1066666667e2_dp*t321*t953*t5087 + | ^ +Warning: 't953' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:62: - 5135 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1184) - | ^ -Warning: 't402' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: + 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + | ^ +note: 't953' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: - 5034 | *(t872) - | ^ -Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: Warning: 't394' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: + 4637 | *t339*t969 + | ^ +Warning: 't950' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:56: - 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) - | ^ -Warning: 't393' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5128:65: + 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + | ^ +note: 't950' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3383:38: - 5128 | *t1270 + 0.5e1_dp/0.2e1_dp*(t388)*(t393)*(t1198) - | ^ -Warning: 't390' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: + 3383 | t341 = 0.1e1_dp/t19/t95 + | ^ +Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:50: - 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 - | ^ -Warning: 't389' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5034:24: + 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + | ^ +note: 't95' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5207:56: - 5034 | *(t872) - | ^ -Warning: 't388' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: + 5207 | t5607 = 0.5866666667e2_dp*t307*t949*t5069 + | ^ +Warning: 't949' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:45: - 5145 | *t155*t44*t726 - | ^ -Warning: 't382' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: + 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + | ^ +note: 't949' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) - | ^ -Warning: 't379' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't946' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:39: - 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 - | ^ -Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4992:25: + 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + | ^ +note: 't946' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: - 4992 | t865 = t864*t374 - | ^ -Warning: 't374' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: + 4629 | *t321*t953*t1625 + | ^ +Warning: 't941' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:76: - 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 - | ^ -Warning: 't373' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: + 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + | ^ +note: 't941' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4615:31: - 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) - | ^ -Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5109:35: + 4615 | t3682 = t24*t940 + | ^ +Warning: 't940' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:70: - 5109 | *t487 + t1205*t342 - | ^ -Warning: 't369' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4989:116: + 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + | ^ +note: 't940' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4238:70: - 4989 | *t807) - | ^ -Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: + 4238 | *t371 - 0.4266666668e2_dp*t2220/t1014/t94*t1058 + | ^ +Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:64: - 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 - | ^ -Warning: 't367' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4989:116: + 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + | ^ +note: 't94' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: - 4989 | *t807) - | ^ -Warning: 't360' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5109:35: + 4637 | *t339*t969 + | ^ +Warning: 't930' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:59: - 5109 | *t487 + t1205*t342 - | ^ -Warning: 't359' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4989:116: + 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + | ^ +note: 't930' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5189:50: - 4989 | *t807) - | ^ -Warning: 't355' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: + 5189 | t5562 = 0.5866666667e2_dp*t93*t4820 + | ^ +Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:53: - 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 - | ^ -Warning: 't352' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: + 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + | ^ +note: 't93' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 5145 | *t155*t44*t726 - | ^ -Warning: 't351' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't929' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:48: - 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 - | ^ -Warning: 't350' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: + 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + | ^ +note: 't929' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4665:39: - 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 - | ^ -Warning: 't346' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5100:32: + 4665 | *t165*t3865*t237 + | ^ +Warning: 't922' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:30: - 5100 | t1270 = t345*t127*t1189 - | ^ -Warning: 't345' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5109:35: + 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + | ^ +note: 't922' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3362:29: - 5109 | *t487 + t1205*t342 - | ^ -Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5016:23: + 3362 | t298 = t92*t97 + | ^ +Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:24: - 5016 | *(t939) - | ^ -Warning: 't341' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: + 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + | ^ +note: 't92' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: - 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) - | ^ -Warning: 't340' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: + 4851 | *t289*t294*t1553 + | ^ +Warning: 't918' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:19: - 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 - | ^ -Warning: 't334' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5075:26: + 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + | ^ +note: 't918' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: - 5075 | t1174 = t476*t333 - | ^ -Warning: 't333' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4962:33: + 4859 | *t83*t45*t3581*t140 + | ^ +Warning: 't914' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:13: - 4962 | t782 = 0.1e1_dp/t332/t82 - | ^ -Warning: 't332' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: + 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + | ^ +note: 't914' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4798:66: - 5145 | *t155*t44*t726 - | ^ -Warning: 't330' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5017:25: + 4798 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 + | ^ +Warning: 't907' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:94: - 5017 | t956 = t136*t329 - | ^ -Warning: 't329' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: + 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + | ^ +note: 't907' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: - 5073 | - (16._dp*t469*t203)) - | ^ -Warning: 't327' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: + 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 + | ^ +Warning: 't906' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:88: - 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) - | ^ -Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: + 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + | ^ +note: 't906' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3961:39: - 5073 | - (16._dp*t469*t203)) - | ^ -Warning: 't313' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: 't310' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: + 3961 | t1640 = 0.1e1_dp/t787/t9 + | ^ +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:76: - 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) - | ^ -Warning: 't309' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: + 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + | ^ +note: 't9' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5442:57: - 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 - | ^ -Warning: 't306' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: + 5442 | t6216 = 0.8333333340e-1_dp*t429*t897*t4701 + | ^ +Warning: 't897' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:72: - 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) - | ^ -Warning: 't305' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: + 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + | ^ +note: 't897' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: - 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 - | ^ -Warning: 't303' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5021:25: + 4870 | t3869 + t4657 + t4696) + | ^ +Warning: 't893' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:60: - 5021 | t985 = t140*t302 - | ^ -Warning: 't302' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: + 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + | ^ +note: 't893' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4719:70: - 5096 | - t450*t239 + 2._dp*t85*t706 - t85*t723) - | ^ -Warning: 't300' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: + 4719 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 + | ^ +Warning: 't886' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:48: - 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) - | ^ -Warning: 't299' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: + 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + | ^ +note: 't886' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4719:70: - 5096 | - t450*t239 + 2._dp*t85*t706 - t85*t723) - | ^ -Warning: 't296' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: Warning: 't290' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: + 4719 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 + | ^ +Warning: 't882' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:42: - 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) - | ^ -Warning: 't289' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: + 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + | ^ +note: 't882' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3521:49: - 5145 | *t155*t44*t726 - | ^ -Warning: 't286' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5146:97: + 3521 | *t615 - 0.20e1_dp*t102*t646 + | ^ +Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:30: - 5146 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t283*t545 - t80*(t1319 + t1443)*Clda)*sx - | ^ -Warning: 't283' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: + 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + | ^ +note: 't88' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: - 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 - | ^ -Warning: 't281' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4959:42: + 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + | ^ +Warning: 't878' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:25: - 4959 | t171*t752 - t210*t171*t769 - | ^ -Warning: 't279' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: + 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + | ^ +note: 't878' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: - 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) - | ^ -Warning: 't278' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: + 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + | ^ +Warning: 't874' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:13: - 4949 | t171*t706 - t210*t171*t723 - | ^ -Warning: 't277' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: + 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + | ^ +note: 't874' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: - 4943 | t229) - (48._dp*t274*t235)) - | ^ -Warning: 't274' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: 't270' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: 't269' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: 't266' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: 't265' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4959:42: + 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 + | ^ +Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:93: - 4959 | t171*t752 - t210*t171*t769 - | ^ -Warning: 't263' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: + 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + | ^ +note: 't87' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: - 4949 | t171*t706 - t210*t171*t723 - | ^ -Warning: 't262' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4936:24: + 4726 | *t58*t3796*t71 + | ^ +Warning: 't866' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:82: - 4936 | t667 = t14*t261 - | ^ -Warning: 't261' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4938:72: + 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + | ^ +note: 't866' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: - 4938 | - 0.16e2_dp/0.3e1_dp*t257*t196*t199 - (16._dp*t258*t203) - | ^ -Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4938:72: Warning: 't257' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: + 4755 | t192*t68*t4256*t65 + | ^ +Warning: 't865' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:76: - 4956 | + 30._dp*a5*t21*t54*t65) - | ^ -Warning: 't256' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4938:72: + 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + | ^ +note: 't865' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4712:66: - 4938 | - 0.16e2_dp/0.3e1_dp*t257*t196*t199 - (16._dp*t258*t203) - | ^ -Warning: 't253' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4938:72: Warning: 't252' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: + 4712 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 + | ^ +Warning: 't864' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:70: - 4949 | t171*t706 - t210*t171*t723 - | ^ -Warning: 't249' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4939:24: + 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + | ^ +note: 't864' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: - 4939 | t700 = t248*t18 - | ^ -Warning: 't248' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: + 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + | ^ +Warning: 't863' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:64: - 5145 | *t155*t44*t726 - | ^ -Warning: 't246' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: + 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + | ^ +note: 't863' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: - 4949 | t171*t706 - t210*t171*t723 - | ^ -Warning: 't240' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5096:132: + 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + | ^ +Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:52: - 5096 | - t450*t239 + 2._dp*t85*t706 - t85*t723) - | ^ -Warning: 't239' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4940:30: + 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + | ^ +note: 't86' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4747:29: - 4940 | t706 = t618*t238*t277 - | ^ -Warning: 't238' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: + 4747 | *t3382 + | ^ +Warning: 't859' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:47: - 4943 | t229) - (48._dp*t274*t235)) - | ^ -Warning: 't235' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: Warning: 't229' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: + 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + | ^ +note: 't859' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4559:56: - 4930 | /t12*t63)) - | ^ -Warning: 't227' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: + 4559 | t3497 = 0.2400000000e2_dp*t473*t852*t1483 + | ^ +Warning: 't852' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:29: - 4943 | t229) - (48._dp*t274*t235)) - | ^ -Warning: 't223' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: + 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + | ^ +note: 't852' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4238:70: - 4930 | /t12*t63)) - | ^ -Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4943:132: + 4238 | *t371 - 0.4266666668e2_dp*t2220/t1014/t94*t1058 + | ^ +Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:17: - 4943 | t229) - (48._dp*t274*t235)) - | ^ -Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: + 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + | ^ +note: 't85' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3485:108: - 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 + 3485 | t46*t541))*sx | ^ -Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: +Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:12: - 4930 | /t12*t63)) - | ^ -Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: + 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + | ^ +note: 't84' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4833:71: - 4956 | + 30._dp*a5*t21*t54*t65) - | ^ -Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4921:33: + 4833 | *t3507 - t3512)*t149*t160 + | ^ +Warning: 't833' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:94: - 4921 | t618 = 0.1e1_dp/t211/t67 - | ^ -Warning: 't211' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4931:30: + 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + | ^ +note: 't833' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5426:37: - 4931 | t657 = t210*t171*t655 - | ^ -Warning: 't210' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: + 5426 | t6175 = t83*t597*t1688 + | ^ +Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:88: - 4949 | t171*t706 - t210*t171*t723 - | ^ -Warning: 't208' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4904:35: + 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + | ^ +note: 't83' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4555:38: - 4904 | t575 = 4._dp*t11*t179*t207 - | ^ -Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4897:24: + 4555 | t165*t171*t3449 + | ^ +Warning: 't827' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:83: - 4897 | t558 = t14*t206 - | ^ -Warning: 't206' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: + 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + | ^ +note: 't827' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4682:40: - 5073 | - (16._dp*t469*t203)) - | ^ -Warning: 't203' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4913:25: + 4682 | *t400*t1333*t1410 + | ^ +Warning: 't822' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:71: - 4913 | t599 = t198*t192 - | ^ -Warning: 't198' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: + 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + | ^ +note: 't822' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4555:38: - 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) - | ^ -Warning: 't197' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: + 4555 | t165*t171*t3449 + | ^ +Warning: 't815' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:65: - 5073 | - (16._dp*t469*t203)) - | ^ -Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: + 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + | ^ +note: 't815' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: - 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) - | ^ -Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: + 4870 | t3869 + t4657 + t4696) + | ^ +Warning: 't804' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:59: - 5073 | - (16._dp*t469*t203)) - | ^ -Warning: 't189' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4905:23: + 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + | ^ +note: 't804' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 4905 | t576 = t4*t188 - | ^ -Warning: 't188' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't801' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:53: - 5073 | - (16._dp*t469*t203)) - | ^ -Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: + 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + | ^ +note: 't801' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) - | ^ -Warning: 't184' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't800' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:47: - 5073 | - (16._dp*t469*t203)) - | ^ -Warning: 't183' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: + 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + | ^ +note: 't800' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3558:118: - 4949 | t171*t706 - t210*t171*t723 - | ^ -Warning: 't180' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: + 3558 | *t83*t653 - 0.2222222224e0_dp*t144*t46*t739))*sx + | ^ +Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:41: - 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) - | ^ -Warning: 't179' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: + 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + | ^ +note: 't8' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4536:32: - 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) - | ^ -Warning: 't178' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4911:34: + 4536 | t12*t1058 + | ^ +Warning: 't797' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:37: - 4911 | t594 = t56*r3*t58*t5*t177 - | ^ -Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: + 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + | ^ +note: 't797' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3485:108: - 4949 | t171*t706 - t210*t171*t723 - | ^ -Warning: 't174' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: Warning: 't173' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4924:36: + 3485 | t46*t541))*sx + | ^ +Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:95: - 4924 | t623 = 2._dp*t210*t171*t620 - | ^ -Warning: 't171' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4949:42: + 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + | ^ +note: 't79' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4879:42: - 4949 | t171*t706 - t210*t171*t723 + 4879 | t4721 = 0.1e1_dp/t787*t2480 | ^ -Warning: 't170' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4935:25: - - 4935 | t664 = t248*t169 - | ^ -Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: +Warning: 't787' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:90: - 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) - | ^ -Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: 't96' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5135:58: + 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + | ^ +note: 't787' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4927:59: - 5135 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1184) - | ^ -Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: + 4927 | - 0.2400000000e2_dp*t786/t2492*t1058 + | ^ +Warning: 't786' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:84: - 5176 | *t421*t422*t1533 - | ^ -Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: + 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + | ^ +note: 't786' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4536:32: - 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) - | ^ -Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4784:22: + 4536 | t12*t1058 + | ^ +Warning: 't782' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:72: - 4784 | t332 = t92**2 - | ^ -Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: + 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + | ^ +note: 't782' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: - 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) - | ^ -Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5023:29: + 4516 | + t3288) + | ^ +Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:66: - 5023 | t995 = t140*t90*t108 - | ^ -Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4925:32: + 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + | ^ +note: 't78' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4670:32: - 4925 | t632 = 0.1e1_dp/t9/t594 + 4670 | t3925 = t777*t561 | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: +Warning: 't777' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:61: - 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) - | ^ -Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: + 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + | ^ +note: 't777' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: - 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) - | ^ -Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: + 4603 | *t3339 + | ^ +Warning: 't773' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:49: - 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) - | ^ -Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5109:35: + 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + | ^ +note: 't773' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: - 5109 | *t487 + t1205*t342 - | ^ -Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5189:67: + 4629 | *t321*t953*t1625 + | ^ +Warning: 't772' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:43: - 5189 | (t1537) - 0.75e2_dp/0.4e1_dp*(t340)*(t793)*(t1529) - | ^ -Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4962:33: + 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + | ^ +note: 't772' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 4962 | t782 = 0.1e1_dp/t332/t82 - | ^ -Warning: 't82' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5196:71: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't769' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:37: - 5196 | e_ndrho_ndrho = e_ndrho_ndrho + (-t80*(t1576 + t1672)*Clda)*sx - | ^ -Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4912:27: + 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + | ^ +note: 't769' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4542:57: - 4912 | t597 = t24/t8/t594 - | ^ -Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4961:22: + 4542 | *t102*t3363 - 0.20e1_dp*t102*t3379 + | ^ +Warning: 't766' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:31: - 4961 | t774 = t78**2 - | ^ -Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5040:23: + 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + | ^ +note: 't766' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: - 5040 | t1047 = t75**2 - | ^ -Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4933:67: + 4613 | + 0.3200000000e2_dp*t1055*t3674 + | ^ +Warning: 't764' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:19: - 4933 | + t623 - t657 + 0.10e2_dp/0.9e1_dp*t73*t219*t56*t58 - | ^ -Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4978:64: + 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + | ^ +note: 't764' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: - 4978 | + t623 - t657 + 0.10e2_dp/0.9e1_dp*t72*t219*t192 - | ^ -Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4757:53: + 4870 | t3869 + t4657 + t4696) + | ^ +Warning: 't754' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:13: - 4757 | t281 = 2._dp*t249*t70 + t11*t263 - t210*t279 - | ^ -Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4903:34: + 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + | ^ +note: 't754' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: - 4903 | t572 = 6._dp*t11*t569*t69 - | ^ -Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5154:111: + 4870 | t3869 + t4657 + t4696) + | ^ +Warning: 't753' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:95: - 5154 | t68 - 2._dp*t450*t278 + 2._dp*t85*t752 - t85*t769) - | ^ -Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4720:22: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't753' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4884:55: - 4720 | t211 = t67**2 - | ^ -Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: + 4884 | t4732 = 0.6666666672e0_dp*t747*t84*t4729 + | ^ +Warning: 't747' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:89: - 4956 | + 30._dp*a5*t21*t54*t65) - | ^ -Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't747' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3433:29: - 4930 | /t12*t63)) - | ^ -Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4730:31: + 3433 | t446 = t74*rho + | ^ +Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:83: - 4730 | t235 = t60/t61/rho*t63 - | ^ -Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't74' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3991:31: - 4930 | /t12*t63)) - | ^ -Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: + 3991 | t1694 = t45*t739 + | ^ +Warning: 't739' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:78: - 4956 | + 30._dp*a5*t21*t54*t65) - | ^ -Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't739' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4791:39: - 4930 | /t12*t63)) - | ^ -Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4914:26: + 4791 | *t429*t1928*t290 + | ^ +Warning: 't735' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:72: - 4914 | t603 = t46*t31*t6 - | ^ -Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't735' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5379:33: - 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) - | ^ -Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: + 5379 | t6053 = t732*t6052 + | ^ +Warning: 't732' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:66: - 4930 | /t12*t63)) + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ -Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4905:23: - - 4905 | t576 = t4*t188 - | ^ -Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: +note: 't732' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5344:51: - 4930 | /t12*t63)) - | ^ -Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4753:26: + 5344 | t5977 = 0.1111111112e0_dp*t1755*t729 + | ^ +Warning: 't729' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:60: - 4753 | t274 = a5*t38*t54 - | ^ -Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't729' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4712:66: - 4930 | /t12*t63)) + 4712 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 | ^ -Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4900:24: - - 4900 | t564 = t34*t212 - | ^ -Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5151:90: +Warning: 't728' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:54: - 5151 | *t19 + 12._dp*g3*t1*t24*t32) - | ^ -Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4915:28: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't728' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5386:33: - 4915 | t607 = t27*t227*t31 - | ^ -Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4902:23: + 5386 | t6075 = t723*t6052 + | ^ +Warning: 't723' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:48: - 4902 | t569 = t29*t14 - | ^ -Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4930:66: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't723' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5557:54: - 4930 | /t12*t63)) - | ^ -Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4915:28: + 5557 | + t5949 + t5952 + t5954 - t5958 + | ^ +Warning: 't722' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:42: - 4915 | t607 = t27*t227*t31 - | ^ -Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't722' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5357:33: - 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) - | ^ -Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4956:46: + 5357 | t6006 = t719*t1838 + | ^ +Warning: 't719' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:36: - 4956 | + 30._dp*a5*t21*t54*t65) - | ^ -Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4857:47: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't719' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5065:90: - 4857 | t472 = 2._dp*t465*t19 + 4._dp*t469*t32 - | ^ -Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4939:24: + 5065 | t729 - 0.5555555558e-1_dp*t192*t5271 - 0.5000000001e0_dp*t732*t4908 + | ^ +Warning: 't716' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:30: - 4939 | t700 = t248*t18 - | ^ -Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't716' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4003:31: - 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5068:64: + 4003 | t1715 = t713*t67 + | ^ +Warning: 't713' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:24: - 5068 | - t80*(t1074 + t1118)*Clda)*sx - | ^ -Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't713' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4049:51: - 5176 | *t421*t422*t1533 - | ^ -Warning: 't161' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4918:64: + 4049 | t1797 = 0.8999999998e1_dp*t1795*t710 + | ^ +Warning: 't710' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:18: - 4918 | 0.32e2_dp/0.3e1_dp*t197*t603 + (20._dp*t25*t607) - | ^ -Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5195:132: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't710' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3549:87: - 5195 | *t155*t44*t772) - | ^ -Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: + 3549 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 + | ^ +Warning: 't71' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:12: - 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) - | ^ -Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: + 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + | ^ +note: 't71' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4040:51: - 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) - | ^ -Warning: 't154' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: + 4040 | t1779 = 0.5000000001e0_dp*t1777*t709 + | ^ +Warning: 't709' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:93: - 5176 | *t421*t422*t1533 - | ^ -Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: + 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + | ^ +note: 't709' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5065:90: - 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) - | ^ -Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: + 5065 | t729 - 0.5555555558e-1_dp*t192*t5271 - 0.5000000001e0_dp*t732*t4908 + | ^ +Warning: 't708' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:87: - 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) - | ^ -Warning: 't146' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5176:33: + 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + | ^ +note: 't708' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4197:33: - 5176 | *t421*t422*t1533 + 4197 | t2114 = t707*t2113 | ^ -Warning: 't145' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4990:25: +Warning: 't707' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:81: - 4990 | t863 = t125*t141 - | ^ -Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5073:117: + 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + | ^ +note: 't707' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5384:42: - 5073 | - (16._dp*t469*t203)) - | ^ -Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5122:26: + 5384 | t6066 = t1519*t705*t561*t65 + | ^ +Warning: 't705' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:75: - 5122 | t1397 = t136*t137 - | ^ -Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5195:132: + 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + | ^ +note: 't705' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: - 5195 | *t155*t44*t772) - | ^ -Warning: 't134' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5055:107: + 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + | ^ +Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:69: - 5055 | t1065*t422*t1066*t350) + (5._dp*t1071*t423) - | ^ -Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4959:42: + 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + | ^ +note: 't70' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3374:29: - 4959 | t171*t752 - t210*t171*t769 - | ^ -Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5182:80: + 3374 | t321 = t7*t219 + | ^ +Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:64: - 5182 | *t367*t405*t1552) - | ^ -Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4995:39: + 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + | ^ +note: 't7' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4451:30: - 4995 | t878 = 0.1e1_dp/t128/t115/t114 - | ^ -Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: + 4451 | t3097 = t66*t69 + | ^ +Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:60: - 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 - | ^ -Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5098:26: + 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + | ^ +note: 't69' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4118:56: - 5098 | t1264 = t125*t126 - | ^ -Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5092:61: + 4118 | t1952 = 0.5555555557e-1_dp*t165*t689*t433 + | ^ +Warning: 't689' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:55: - 5092 | t1224*t375 - t110*t1155*t83*t118 + t920*t484 - | ^ -Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4975:34: + 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + | ^ +note: 't689' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3419:30: - 4975 | t811 = 0.1e1_dp/t121/t114 - | ^ -Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4696:23: + 3419 | t406 = t68*t140 + | ^ +Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:49: - 4696 | t177 = t12*rho - | ^ -Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5145:31: + 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + | ^ +note: 't68' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4907:73: - 5145 | *t155*t44*t726 - | ^ -Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4966:39: + 4907 | *t165*t166*t4729 + 0.3333333334e0_dp*t55*t57*t4782 + | ^ +Warning: 't679' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:44: - 4966 | t792 = 0.1e1_dp/t117/t789/t114 - | ^ -Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4790:34: + 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + | ^ +note: 't679' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: - 4790 | t345 = 0.1e1_dp/t117/t116 - | ^ -Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5117:108: + 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) + | ^ +Warning: 't673' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:38: - 5117 | *t457*t306) + 0.5e1_dp/0.2e1_dp*t1071*t533 - | ^ -Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5079:32: + 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + | ^ +note: 't673' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5418:38: - 5079 | t1190 = t372*t114*t1189 - | ^ -Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5101:32: + 5418 | t6160 = t147*t1885*t672 + | ^ +Warning: 't672' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:32: - 5101 | t1277 = t372*t113*t1189 + 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ -Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5082:26: - - 5082 | t1208 = t110*t111 - | ^ -Warning: 't111' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4982:132: - - 4982 | *t610*t68 - 2._dp*t296*t239 + 2._dp*t85*t620 - t85*t655)) - | ^ -Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5170:58: +note: 't672' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4139:55: - 5170 | + 0.3e1_dp/0.2e1_dp*(t400)*(t405)*(t1566) - | ^ -Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5066:101: + 4139 | t1997 = 0.1666666667e0_dp*t165*t171*t668 + | ^ +Warning: 't668' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3165:76: - 5066 | *t784) + 0.10e2_dp/0.3e1_dp*(t330)*(t389)*(t428) - | ^ -Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5019:30: + 3165 | t6603, t6611, t6620, t6621, t6630, t6640, t6658, t6665, t6669, t668 + | ^ +note: 't668' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3458:30: - 5019 | t966 = t136*t105*t108 + 3458 | t516 = t66*t515 | ^ -Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5151:90: - - 5151 | *t19 + 12._dp*g3*t1*t24*t32) - | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: +Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3164:92: - 5003 | /0.3e1_dp*t321*t603 + (20._dp*t100*t607)) - | ^ -Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5003:132: Warning: 't100' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4740:24: + 3164 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & + | ^ +note: 't66' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5414:38: - 4740 | t249 = t248*t10 - | ^ -Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4743:24: + 5414 | t6141 = t658*t575*t1925 + | ^ +Warning: 't658' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3164:73: - 4743 | t256 = t1*ndrho - | ^ -Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5635:90: + 3164 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & + | ^ +note: 't658' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3990:49: - 5635 | 1.0_dp/Q*(dQrho*dQndrho + d2Qrhondrho) + 1.0_dp/(Q*Q)*dQrho*dQndrho - | ^ -Warning: 'dqrho' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3649:76: + 3990 | t1693 = 0.3333333336e0_dp*t55*t653 + | ^ +Warning: 't653' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3164:33: - 3649 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t1004, & - | ^ -note: 'dqrho' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:5671:94: + 3164 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & + | ^ +note: 't653' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3903:49: - 5671 | 1.0_dp/(Q*Q)*(-Q*dQndrho*dQndrho - Q*d2Qndrhondrho + dQndrho*dQndrho) - | ^ -Warning: 'dqndrho' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3649:69: + 3903 | t1545 = 0.3333333336e0_dp*t55*t650 + | ^ +Warning: 't650' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3164:13: - 3649 | REAL(KIND=dp) :: d2Qndrhondrho, d2Qrhondrho, d2Qrhorho, dQndrho, dQrho, Q, t1, t10, t1004, & - | ^ -note: 'dqndrho' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4430:97: + 3164 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & + | ^ +note: 't650' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3497:59: - 4430 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t322*t696 - t80*(t1652 + t1860)*Clda)*sx - | ^ -Warning: 't696' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: + 3497 | *t71 - 0.5000000001e0_dp*t60*t561*t65 + | ^ +Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3163:93: - 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) - | ^ -Warning: 't691' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: Warning: 't690' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: + 3163 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & + | ^ +note: 't65' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4096:31: - 4461 | - (4._dp*t568*t570) - | ^ -Warning: 't684' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: Warning: 't681' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: + 4096 | t1902 = t68*t649 + | ^ +Warning: 't649' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3163:74: - 4376 | *t320 - | ^ -Warning: 't677' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: + 3163 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & + | ^ +note: 't649' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: - 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) - | ^ -Warning: 't673' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: Warning: 't670' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: Warning: 't664' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: Warning: 't661' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: + 5031 | *t105*t5118 + | ^ +Warning: 't646' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3163:54: - 4376 | *t320 - | ^ -Warning: 't656' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: + 3163 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & + | ^ +note: 't646' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5197:53: - 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) - | ^ -Warning: 't652' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4377:27: + 5197 | t5579 = 0.80e1_dp*t102*t327*t645*t1443 + | ^ +Warning: 't645' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3163:41: - 4377 | t1675 = t1241*t651 - | ^ -Warning: 't651' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: + 3163 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & + | ^ +note: 't645' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4169:32: - 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) - | ^ -Warning: 't649' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4481:25: + 4169 | t2054 = t786*t640 + | ^ +Warning: 't640' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3162:88: - 4481 | *(t1886) - | ^ -Warning: 't638' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4383:27: + 3162 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & + | ^ +note: 't640' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: - 4383 | t1695 = t1203*t637 - | ^ + 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + | ^ Warning: 't637' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: - - 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) - | ^ -Warning: 't635' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: - - 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) - | ^ -Warning: 't629' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4366:26: - - 4366 | t1645 = t627*t531 - | ^ -Warning: 't627' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4405:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3162:47: - 4405 | t1781 = t176*t626 - | ^ -Warning: 't626' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: + 3162 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & + | ^ +note: 't637' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: - 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) - | ^ -Warning: 't623' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4357:26: + 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + | ^ +Warning: 't635' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3162:20: - 4357 | t1583 = t621*t142 - | ^ -Warning: 't621' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: + 3162 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & + | ^ +note: 't635' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: - 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) - | ^ -Warning: 't617' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't616' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't612' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: + 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + | ^ +Warning: 't628' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3161:40: - 4356 | t419*t77*t871)/0.2e1_dp) - | ^ -Warning: 't611' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't610' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: + 3161 | t6267, t6268, t627, t6271, t628, t6281, t6283, t6290, t6291, t63, t6308, t6338, t6339, & + | ^ +note: 't628' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5157:51: - 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) - | ^ -Warning: 't608' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4341:47: + 5157 | t5480 = 0.1760000000e3_dp*t5060*t627 + | ^ +Warning: 't627' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3161:27: - 4341 | + t1079*t210*t1080*t316) - | ^ -Warning: 't607' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: + 3161 | t6267, t6268, t627, t6271, t628, t6281, t6283, t6290, t6291, t63, t6308, t6338, t6339, & + | ^ +note: 't627' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5200:56: - 4356 | t419*t77*t871)/0.2e1_dp) - | ^ -Warning: 't604' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't599' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: + 5200 | t5590 = 0.80e1_dp*t624*t22*t326*t136*t233 + | ^ +Warning: 't624' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3160:41: - 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) - | ^ -Warning: 't596' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: + 3160 | t6219, t6222, t6223, t6227, t624, t6247, t6249, t6252, t6253, t6256, t6257, t6260, t6263, & + | ^ +note: 't624' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3450:35: - 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) - | ^ -Warning: 't595' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't593' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: + 3450 | *t61*t262*t25 + | ^ +Warning: 't62' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3159:61: - 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) - | ^ -Warning: 't592' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: Warning: 't590' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4330:26: + 3159 | REAL(kind=dp) :: t6186, t6189, t6192, t6194, t6198, t62, t6201, t6207, t6210, t6213, t6216, & + | ^ +note: 't62' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: - 4330 | t1480 = t589*t373 - | ^ -Warning: 't589' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: + 5031 | *t105*t5118 + | ^ +Warning: 't615' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3157:96: - 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) - | ^ -Warning: 't586' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't584' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: + 3157 | t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & + | ^ +note: 't615' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3940:32: - 4461 | - (4._dp*t568*t570) - | ^ -Warning: 't570' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: Warning: 't568' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: + 3940 | t1608 = t953*t614 + | ^ +Warning: 't614' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3157:76: - 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) - | ^ -Warning: 't567' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4432:111: + 3157 | t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & + | ^ +note: 't614' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3345:34: - 4432 | t68 - 2._dp*t561*t317 + 2._dp*t85*t900 - t85*t917) - | ^ -Warning: 't565' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: + 3345 | t264 = t61*t262*t17 + | ^ +Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3156:73: - 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) - | ^ -Warning: 't564' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: Warning: 't561' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4324:64: + 3156 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & + | ^ +note: 't61' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: - 4324 | - t80*(t1189 + t1408)*Clda)*sx - | ^ -Warning: 't555' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: + 5031 | *t105*t5118 + | ^ +Warning: 't609' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3156:40: - 4376 | *t320 - | ^ -Warning: 't550' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: + 3156 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & + | ^ +note: 't609' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3929:32: - 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) - | ^ -Warning: 't549' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4312:27: + 3929 | t1592 = t949*t608 + | ^ +Warning: 't608' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3156:27: - 4312 | t1402 = t548*t1401 + 3156 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & | ^ -Warning: 't548' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: - - 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) - | ^ -Warning: 't546' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: Warning: 't545' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4309:30: +note: 't608' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 4309 | t1393 = t75/t544/t199 - | ^ -Warning: 't544' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4248:21: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't605' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3155:34: - 4248 | *t58 - | ^ -Warning: 't539' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: + 3155 | t6044, t6047, t6049, t605, t6052, t6053, t6056, t6058, t6060, t6063, t6066, t6074, t6075, & + | ^ +note: 't605' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4037:31: - 4429 | *t461*t320) - (2._dp*t91*t344*t875) - | ^ -Warning: 't538' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: + 4037 | t1774 = t60*t496 + | ^ +Warning: 't60' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3153:64: - 4322 | *t199*t285 + t550*t285)) - | ^ -Warning: 't537' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: + 3153 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & + | ^ +note: 't60' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3393:30: - 4376 | *t320 - | ^ -Warning: 't534' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: Warning: 't533' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: + 3393 | t365 = t6*ndrho + | ^ +Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3153:59: - 4461 | - (4._dp*t568*t570) - | ^ -Warning: 't532' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: + 3153 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & + | ^ +note: 't6' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3902:49: - 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) - | ^ -Warning: 't531' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: + 3902 | t1543 = 0.3333333336e0_dp*t55*t598 + | ^ +Warning: 't598' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3153:27: - 4376 | *t320 - | ^ -Warning: 't528' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: + 3153 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & + | ^ +note: 't598' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5426:37: - 4322 | *t199*t285 + t550*t285)) - | ^ -Warning: 't526' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: + 5426 | t6175 = t83*t597*t1688 + | ^ +Warning: 't597' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3152:76: - 4376 | *t320 - | ^ -Warning: 't523' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: + 3152 | REAL(kind=dp) :: t5954, t5956, t5958, t5960, t5963, t5964, t5966, t597, t5971, t5973, t5975, & + | ^ +note: 't597' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4135:56: - 4322 | *t199*t285 + t550*t285)) - | ^ -Warning: 't521' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4278:38: + 4135 | t1987 = 0.8333333335e-1_dp*t429*t437*t593 + | ^ +Warning: 't593' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3151:20: - 4278 | (t511)*(t516)*(t1260) - | ^ -Warning: 't517' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: + 3151 | t5929, t593, t5932, t5938, t5940, t5942, t5944, t5949, t5952 + | ^ +note: 't593' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3840:50: - 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) - | ^ -Warning: 't516' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4419:65: + 3840 | t1408 = 0.4444444448e0_dp*t214*t590 + | ^ +Warning: 't590' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3150:32: - 4419 | *t1739 + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t1712) - | ^ -Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4295:78: + 3150 | t5891, t5898, t59, t590, t5902, t5905, t5908, t5911, t5913, t5918, t5922, t5925, t5926, & + | ^ +note: 't590' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3534:30: - 4295 | t478*t512*t969) - | ^ -Warning: 't512' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4278:38: + 3534 | t707 = t187*t59 + | ^ +Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3150:26: - 4278 | (t511)*(t516)*(t1260) - | ^ -Warning: 't511' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4278:38: Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4481:25: + 3150 | t5891, t5898, t59, t590, t5902, t5905, t5908, t5911, t5913, t5918, t5922, t5925, t5926, & + | ^ +note: 't59' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4917:60: - 4481 | *(t1886) - | ^ -Warning: 't504' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4412:70: + 4917 | t4812 = 0.1333333334e1_dp*t217*t46*t589*t1447 + | ^ +Warning: 't589' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3149:97: - 4412 | t1796*t1762 + 0.5e1_dp/0.2e1_dp*(t499)*(t504)*(t1632) - | ^ -Warning: 't501' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4305:31: + 3149 | t5850, t5854, t5857, t5861, t5864, t5868, t5869, t5875, t5880, t5881, t5885, t5888, t589, & + | ^ +note: 't589' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4122:31: - 4305 | *(t457)*(t933) + 4122 | t1962 = t585*rho | ^ -Warning: 't500' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4278:38: +Warning: 't585' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3148:97: - 4278 | (t511)*(t516)*(t1260) - | ^ -Warning: 't499' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: + 3148 | t5819, t5822, t5825, t5828, t5830, t5831, t5833, t5835, t5838, t5841, t5845, t5848, t585, & + | ^ +note: 't585' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3348:30: - 4376 | *t320 - | ^ -Warning: 't493' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: + 3348 | t268 = t58*t237 + | ^ +Warning: 't58' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3147:53: - 4322 | *t199*t285 + t550*t285)) - | ^ -Warning: 't490' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4404:124: + 3147 | t5786, t5789, t579, t5792, t5795, t5797, t58, t5801, t5804, t5807, t5810, t5813, t5816, & + | ^ +note: 't58' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: - 4404 | *t471*t875)/0.2e1_dp + (10._dp*t1685*t1762) - | ^ -Warning: 't486' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4263:27: + 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + | ^ +Warning: 't579' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3147:27: - 4263 | t1242 = t1241*t485 + 3147 | t5786, t5789, t579, t5792, t5795, t5797, t58, t5801, t5804, t5807, t5810, t5813, t5816, & | ^ -Warning: 't485' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: - - 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) - | ^ -Warning: 't484' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: - - 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) - | ^ -Warning: 't483' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4404:124: - - 4404 | *t471*t875)/0.2e1_dp + (10._dp*t1685*t1762) - | ^ -Warning: 't480' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: - - 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) - | ^ -Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: - - 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) - | ^ -Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4295:78: - - 4295 | t478*t512*t969) - | ^ -Warning: 't471' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: +note: 't579' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4186:39: - 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) - | ^ -Warning: 't470' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4295:78: + 4186 | t2081*t575*t2082 + | ^ +Warning: 't575' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3146:34: - 4295 | t478*t512*t969) - | ^ -Warning: 't466' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: + 3146 | t5742, t5745, t5749, t575, t5752, t5756, t5760, t5767, t5770, t5773, t5776, t5780, t5783, & + | ^ +note: 't575' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3619:69: - 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) - | ^ -Warning: 't463' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4252:27: + 3619 | *t170*t455*t17 + 0.3333333334e0_dp*t55*t57*t889 + | ^ +Warning: 't57' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3144:53: - 4252 | t1204 = t1203*t462 - | ^ -Warning: 't462' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: + 3144 | t569, t5692, t5695, t5696, t5698, t5699, t57, t5701, t5705 + | ^ +note: 't57' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5481:36: - 4429 | *t461*t320) - (2._dp*t91*t344*t875) - | ^ -Warning: 't461' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4404:124: + 5481 | t5011 + t5001 + | ^ +Warning: 't569' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3144:13: - 4404 | *t471*t875)/0.2e1_dp + (10._dp*t1685*t1762) - | ^ -Warning: 't457' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4397:32: + 3144 | t569, t5692, t5695, t5696, t5698, t5699, t57, t5701, t5705 + | ^ +note: 't569' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4907:73: - 4397 | t1762 = t456*t168*t1687 - | ^ -Warning: 't456' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: + 4907 | *t165*t166*t4729 + 0.3333333334e0_dp*t55*t57*t4782 + | ^ +Warning: 't567' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3143:41: - 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) - | ^ -Warning: 't453' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4305:31: + 3143 | t5660, t5663, t5666, t5667, t567, t5670, t5671, t5673, t5676, t5679, t5682, t5686, t5689, & + | ^ +note: 't567' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4117:56: - 4305 | *(t457)*(t933) - | ^ -Warning: 't452' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4481:25: + 4117 | t1946 = 0.1666666667e0_dp*t165*t1392*t561 + | ^ +Warning: 't561' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3141:60: - 4481 | *(t1886) - | ^ -Warning: 't451' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: + 3141 | t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, t5622, & + | ^ +note: 't561' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3445:30: - 4429 | *t461*t320) - (2._dp*t91*t344*t875) - | ^ -Warning: 't445' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4364:26: + 3445 | t479 = t56*t140 + | ^ +Warning: 't56' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3141:26: - 4364 | t1627 = t627*t444 + 3141 | t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, t5622, & | ^ -Warning: 't444' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: - - 4376 | *t320 - | ^ -Warning: 't442' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4297:26: +note: 't56' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: - 4297 | t1350 = t151*t441 - | ^ -Warning: 't441' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4360:49: + 5031 | *t105*t5118 + | ^ +Warning: 't558' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3140:68: - 4360 | 0.7e1_dp/0.2e1_dp*t435*t437*t875 - | ^ -Warning: 't438' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4360:49: Warning: 't437' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4360:49: Warning: 't435' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4216:26: + 3140 | t5564, t5565, t5568, t557, t5572, t5574, t5575, t5579, t558, t5581, t5585, t5590, t5593, & + | ^ +note: 't558' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5493:79: - 4216 | t1143 = t433*t142 - | ^ -Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: + 5493 | *t327*t2057*t557 - t5456 + t5459 - t5462 + t5466 - t5468 + | ^ +Warning: 't557' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3140:34: - 4356 | t419*t77*t871)/0.2e1_dp) - | ^ -Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't424' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: + 3140 | t5564, t5565, t5568, t557, t5572, t5574, t5575, t5579, t558, t5581, t5585, t5590, t5593, & + | ^ +note: 't557' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: - 4234 | *(t435)*(t437)*(t976) - | ^ -Warning: 't423' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: + 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + | ^ +Warning: 't550' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3138:27: - 4356 | t419*t77*t871)/0.2e1_dp) - | ^ -Warning: 't422' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't420' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: + 3138 | REAL(kind=dp) :: t550, t5503, t5507, t5509, t551, t5511, t5516, t5523, t5525, t5528, t5531, & + | ^ +note: 't550' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5084:55: - 4164 | - t249*t210*t872 - | ^ -Warning: 't419' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: + 5084 | t5301 = 0.3333333336e0_dp*t55*t384*t4729 + | ^ +Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3137:75: - 4234 | *(t435)*(t437)*(t976) - | ^ -Warning: 't418' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't416' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't408' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't406' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4210:31: + 3137 | t5480, t5482, t5484, t5487, t5489, t5492, t5494, t5496, t5499, t55 + | ^ +note: 't55' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3701:31: - 4210 | t1101 = t125*t404*t129 + 3701 | t1071 = t45*t541 | ^ -Warning: 't404' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - - 4234 | *(t435)*(t437)*(t976) - | ^ -Warning: 't403' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4341:47: +Warning: 't541' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3134:83: - 4341 | + t1079*t210*t1080*t316) - | ^ -Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: + 3134 | t5376, t5379, t5383, t5386, t5389, t5397, t5400, t5402, t5406, t5409, t541, t5412, t5415, & + | ^ +note: 't541' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: - 4234 | *(t435)*(t437)*(t976) - | ^ -Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't399' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't397' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4205:30: + 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + | ^ +Warning: 't537' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3133:76: - 4205 | t1065 = t96*t115*t391 - | ^ -Warning: 't391' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: + 3133 | t5343, t5345, t5347, t5351, t5354, t5357, t5360, t5363, t5367, t537, t5370, t5371, t5373, & + | ^ +note: 't537' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4450:69: - 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) - | ^ -Warning: 't388' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4112:23: + 4450 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 + | ^ +Warning: 't534' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3132:90: - 4112 | t713 = t4*t381 - | ^ -Warning: 't381' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: + 3132 | t5314, t5317, t5320, t5323, t5326, t5329, t5330, t5333, t5335, t5338, t5339, t534, t5342, & + | ^ +note: 't534' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4463:34: - 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 - | ^ -Warning: 't380' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: + 4463 | *t503*t2312 + | ^ +Warning: 't531' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3131:87: - 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) - | ^ -Warning: 't379' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: Warning: 't377' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: + 3131 | REAL(kind=dp) :: t5294, t5295, t5298, t53, t530, t5301, t5303, t5305, t5308, t531, t5311, & + | ^ +note: 't531' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4463:34: - 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 - | ^ -Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: + 4463 | *t503*t2312 + | ^ +Warning: 't530' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3131:53: - 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) - | ^ -Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: + 3131 | REAL(kind=dp) :: t5294, t5295, t5298, t53, t530, t5301, t5303, t5305, t5308, t531, t5311, & + | ^ +note: 't530' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4014:51: - 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 - | ^ -Warning: 't374' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4330:26: + 4014 | t1735 = 0.3703703705e-1_dp*t719*t527 + | ^ +Warning: 't527' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3130:26: - 4330 | t1480 = t589*t373 + 3130 | t526, t5262, t527, t5270, t5271, t5276, t5280, t5281, t5284, t5291 | ^ -Warning: 't373' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: +note: 't527' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4472:64: - 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 - | ^ -Warning: 't370' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: + 4472 | *t2622*t71 - 0.1666666668e0_dp*t1106*t886 + | ^ +Warning: 't526' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3130:13: - 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) - | ^ -Warning: 't369' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: + 3130 | t526, t5262, t527, t5270, t5271, t5276, t5280, t5281, t5284, t5291 + | ^ +note: 't526' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: - 4356 | t419*t77*t871)/0.2e1_dp) - | ^ -Warning: 't365' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: + 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + | ^ +Warning: 't520' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3129:40: - 4234 | *(t435)*(t437)*(t976) - | ^ -Warning: 't364' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4187:24: + 3129 | t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, t5256, & + | ^ +note: 't520' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: - 4187 | t967 = t361*t82 - | ^ -Warning: 't361' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: + 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + | ^ +Warning: 't517' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3129:20: - 4356 | t419*t77*t871)/0.2e1_dp) - | ^ -Warning: 't359' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't352' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: + 3129 | t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, t5256, & + | ^ +note: 't517' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: - 4429 | *t461*t320) - (2._dp*t91*t344*t875) - | ^ -Warning: 't345' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4248:21: + 4726 | *t58*t3796*t71 + | ^ +Warning: 't516' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3128:94: - 4248 | *t58 - | ^ -Warning: 't344' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: + 3128 | t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, t516, & + | ^ +note: 't516' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: - 4429 | *t461*t320) - (2._dp*t91*t344*t875) - | ^ -Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: + 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + | ^ +Warning: 't515' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3128:88: - 4356 | t419*t77*t871)/0.2e1_dp) - | ^ -Warning: 't341' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: + 3128 | t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, t516, & + | ^ +note: 't515' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4463:34: - 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) - | ^ -Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4186:132: + 4463 | *t503*t2312 + | ^ +Warning: 't512' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3128:40: - 4186 | *t759*t68 - 2._dp*t335*t278 + 2._dp*t85*t769 - t85*t804)) - | ^ -Warning: 't338' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: + 3128 | t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, t516, & + | ^ +note: 't512' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3756:32: - 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) - | ^ -Warning: 't335' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: Warning: 't332' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: Warning: 't329' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4186:132: + 3756 | t1213 = t511*t225 + | ^ +Warning: 't511' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3128:20: - 4186 | *t759*t68 - 2._dp*t335*t278 + 2._dp*t85*t769 - t85*t804)) - | ^ -Warning: 't328' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: + 3128 | t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, t516, & + | ^ +note: 't511' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5380:52: - 4429 | *t461*t320) - (2._dp*t91*t344*t875) - | ^ -Warning: 't325' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4430:97: + 5380 | t6056 = 0.5555555558e-1_dp*t508*t5271 + | ^ +Warning: 't508' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3127:76: - 4430 | e_ndrho_rho = e_ndrho_rho + (-0.4e1_dp/0.3e1_dp*t322*t696 - t80*(t1652 + t1860)*Clda)*sx - | ^ -Warning: 't322' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: + 3127 | t5043, t5044, t5047, t5050, t5051, t5060, t5065, t5069, t5079, t508, t5083, t5087, t5106, & + | ^ +note: 't508' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: - 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) - | ^ -Warning: 't320' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4177:26: + 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 + | ^ +Warning: 't503' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3126:69: - 4177 | *t210*t917 - | ^ -Warning: 't318' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4432:111: + 3126 | t5011, t5013, t5016, t5019, t5022, t5025, t5028, t5029, t503, t5032, t5035, t5036, t5040, & + | ^ +note: 't503' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3712:31: - 4432 | t68 - 2._dp*t561*t317 + 2._dp*t85*t900 - t85*t917) - | ^ -Warning: 't317' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4341:47: + 3712 | t1106 = t500*t67 + | ^ +Warning: 't500' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3125:58: - 4341 | + t1079*t210*t1080*t316) - | ^ -Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: + 3125 | t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, t5009, & + | ^ +note: 't500' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4295:40: - 4157 | (48._dp*t313*t274) - | ^ -Warning: 't313' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: 't309' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: 't308' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: 't305' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: 't304' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4177:26: + 4295 | *t1368*t166*t2160 + | ^ +Warning: 't50' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3125:52: - 4177 | *t210*t917 - | ^ -Warning: 't302' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: + 3125 | t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, t5009, & + | ^ +note: 't50' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4450:69: - 4164 | - t249*t210*t872 - | ^ -Warning: 't301' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4342:26: + 4450 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 + | ^ +Warning: 't498' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3125:33: - 4342 | t1562 = t300*t251 - | ^ -Warning: 't300' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: + 3125 | t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, t5009, & + | ^ +note: 't498' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: - 4151 | - 0.16e2_dp/0.3e1_dp*t296*t235*t238 - (16._dp*t297*t242) - | ^ -Warning: 't297' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: Warning: 't296' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: + 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + | ^ +Warning: 't496' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3125:27: - 4173 | a5*t21*t54*t65 + 3125 | t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, t5009, & + | ^ +note: 't496' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3341:30: + + 3341 | t245*t17 | ^ -Warning: 't295' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: +Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3122:67: - 4151 | - 0.16e2_dp/0.3e1_dp*t296*t235*t238 - (16._dp*t297*t242) - | ^ -Warning: 't292' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: Warning: 't291' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: + 3122 | t4884, t4887, t4889, t489, t4893, t4895, t4897, t4898, t49, t4901, t4904, t4905, t4907, & + | ^ +note: 't49' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: - 4164 | - t249*t210*t872 - | ^ -Warning: 't288' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4153:24: + 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 + | ^ +Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3122:34: - 4153 | t849 = t287*t18 - | ^ -Warning: 't287' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: + 3122 | t4884, t4887, t4889, t489, t4893, t4895, t4897, t4898, t49, t4901, t4904, t4905, t4907, & + | ^ +note: 't489' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3358:35: - 4376 | *t320 - | ^ -Warning: 't285' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: + 3358 | t289 = rho*t48*omega + | ^ +Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3120:12: - 4164 | - t249*t210*t872 - | ^ -Warning: 't279' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: + 3120 | t48, t4800, t4801, t4804, t4808, t4812, t4817, t4820, t4829, t4830, t4833, t4834, t4837, & + | ^ +note: 't48' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4430:33: - 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) - | ^ -Warning: 't278' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: + 4430 | t1176*t804 + | ^ +Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3119:68: - 4234 | *(t435)*(t437)*(t976) - | ^ -Warning: 't277' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: + 3119 | t4770, t4771, t4772, t4776, t478, t4782, t4786, t4789, t479, t4790, t4793, t4796, t4797, & + | ^ +note: 't479' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4946:39: - 4157 | (48._dp*t313*t274) - | ^ -Warning: 't274' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: 't268' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: + 4946 | t4895 = t478*t1500*t4729 + | ^ +Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3119:41: - 4141 | t63) - | ^ -Warning: 't266' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: + 3119 | t4770, t4771, t4772, t4776, t478, t4782, t4786, t4789, t479, t4790, t4793, t4796, t4797, & + | ^ +note: 't478' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4430:33: - 4157 | (48._dp*t313*t274) - | ^ -Warning: 't262' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: + 4430 | t1176*t804 + | ^ +Warning: 't474' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3118:48: - 4141 | t63) - | ^ -Warning: 't261' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: Warning: 't260' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: + 3118 | t4733, t4734, t4736, t4738, t4739, t474, t4743, t4744, t4748, t4760, t4764, t4768, t4769, & + | ^ +note: 't474' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5469:45: - 4157 | (48._dp*t313*t274) - | ^ -Warning: 't259' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: + 5469 | *t4901 - t4907 + t4911 + | ^ +Warning: 't473' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3117:88: - 4376 | *t320 - | ^ -Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: + 3117 | REAL(kind=dp) :: t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, t4732, & + | ^ +note: 't473' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4058:32: - 4141 | t63) - | ^ -Warning: 't252' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4342:26: + 4058 | t1821 = t472*t262 + | ^ +Warning: 't472' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3117:54: - 4342 | t1562 = t300*t251 - | ^ -Warning: 't251' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4132:33: + 3117 | REAL(kind=dp) :: t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, t4732, & + | ^ +note: 't472' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5550:29: - 4132 | t767 = 0.1e1_dp/t250/t67 - | ^ -Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4143:30: + 5550 | *t6271 + | ^ +Warning: 't471' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3117:27: - 4143 | t806 = t249*t210*t804 - | ^ -Warning: 't249' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: + 3117 | REAL(kind=dp) :: t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, t4732, & + | ^ +note: 't471' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3789:40: - 4164 | - t249*t210*t872 - | ^ -Warning: 't247' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4117:35: + 3789 | t1300 = 0.1e1_dp/t41/t470 + | ^ +Warning: 't470' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3116:38: - 4117 | t724 = 4._dp*t11*t218*t246 - | ^ -Warning: 't246' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4214:26: + 3116 | t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707, t4708 + | ^ +note: 't470' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3415:30: - 4214 | t1121 = t245*t251 - | ^ -Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: + 3415 | t399 = t47*t398 + | ^ +Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3116:32: - 4157 | (48._dp*t313*t274) - | ^ -Warning: 't242' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: Warning: 't238' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4122:25: + 3116 | t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707, t4708 + | ^ +note: 't47' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4366:104: - 4122 | t748 = t237*t231 - | ^ -Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: + 4366 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 + | ^ +Warning: 't466' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3116:20: - 4128 | *t25*t756) - | ^ -Warning: 't236' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4157:34: + 3116 | t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707, t4708 + | ^ +note: 't466' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4381:40: - 4157 | (48._dp*t313*t274) - | ^ -Warning: 't235' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4248:21: + 4381 | *t2763*t446*t2779 + | ^ +Warning: 't462' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:85: - 4248 | *t58 - | ^ -Warning: 't234' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: + 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & + | ^ +note: 't462' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3485:108: - 4151 | - 0.16e2_dp/0.3e1_dp*t296*t235*t238 - (16._dp*t297*t242) + 3485 | t46*t541))*sx + | ^ +Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:72: + + 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & | ^ -Warning: 't228' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: +note: 't46' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4295:40: - 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) - | ^ -Warning: 't227' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4151:72: + 4295 | *t1368*t166*t2160 + | ^ +Warning: 't455' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:46: - 4151 | - 0.16e2_dp/0.3e1_dp*t296*t235*t238 - (16._dp*t297*t242) - | ^ -Warning: 't224' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: + 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & + | ^ +note: 't455' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: - 4128 | *t25*t756) + 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ -Warning: 't223' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: - - 4234 | *(t435)*(t437)*(t976) - | ^ -Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: +Warning: 't451' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:26: - 4164 | - t249*t210*t872 - | ^ -Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: + 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & + | ^ +note: 't451' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4366:104: - 4234 | *(t435)*(t437)*(t976) - | ^ -Warning: 't218' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: + 4366 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 + | ^ +Warning: 't450' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:13: - 4322 | *t199*t285 + t550*t285)) - | ^ -Warning: 't217' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4120:34: + 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & + | ^ +note: 't450' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: - 4120 | t743 = t56*r3*t58*t5*t216 - | ^ -Warning: 't216' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: + 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + | ^ +Warning: 't446' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:77: - 4164 | - t249*t210*t872 - | ^ -Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4135:36: + 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & + | ^ +note: 't446' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5415:38: - 4135 | t772 = 2._dp*t249*t210*t769 - | ^ -Warning: 't210' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4164:32: + 5415 | t6144 = t445*t4512*t668 + | ^ +Warning: 't445' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:71: - 4164 | - t249*t210*t872 - | ^ -Warning: 't209' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4147:25: + 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & + | ^ +note: 't445' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4369:33: - 4147 | t813 = t287*t208 - | ^ -Warning: 't208' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4419:65: + 4369 | t2763 = t1367*t444 + | ^ +Warning: 't444' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:65: - 4419 | *t1739 + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t1712) + 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & | ^ -Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: +note: 't444' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: - 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) - | ^ -Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: + 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + | ^ +Warning: 't437' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:33: - 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) - | ^ -Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: + 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & + | ^ +note: 't437' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4418:57: - 4234 | *(t435)*(t437)*(t976) - | ^ -Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: + 4418 | - 0.5000000001e0_dp*t429*t437*t914 + | ^ +Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:13: - 4322 | *t199*t285 + t550*t285)) - | ^ -Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4261:30: + 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & + | ^ +note: 't433' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: - 4261 | t1240 = t180*t90*t149 - | ^ -Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4136:32: + 4870 | t3869 + t4657 + t4696) + | ^ +Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:85: - 4136 | t781 = 0.1e1_dp/t9/t743 - | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4045:41: + 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & + | ^ +note: 't43' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5413:38: - 4045 | t567 = 2._dp*t288*t88 + t11*t565 - | ^ -Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4186:132: + 5413 | t6138 = t429*t1928*t593 + | ^ +Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:73: - 4186 | *t759*t68 - 2._dp*t335*t278 + 2._dp*t85*t769 - t85*t804)) - | ^ -Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4432:111: + 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & + | ^ +note: 't429' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4520:30: - 4432 | t68 - 2._dp*t561*t317 + 2._dp*t85*t900 - t85*t917) - | ^ -Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4391:81: + 4520 | t3305 = t4*t428 + | ^ +Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:67: - 4391 | + 0.3e1_dp/0.2e1_dp*t478*t484*t1712 - 0.2e1_dp*t478*t512*(t1446) - | ^ -Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: + 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & + | ^ +note: 't428' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5409:56: - 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) - | ^ -Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3927:24: + 5409 | t6126 = 0.1800000000e2_dp*t658*t4764*t425 + | ^ +Warning: 't425' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:33: - 3927 | t352 = t82*t325 - | ^ -Warning: 't82' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4495:71: + 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & + | ^ +note: 't425' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4418:57: - 4495 | e_ndrho_ndrho = e_ndrho_ndrho + (-t80*(t2013 + t2174)*Clda)*sx - | ^ -Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4121:27: + 4418 | - 0.5000000001e0_dp*t429*t437*t914 + | ^ +Warning: 't424' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:27: - 4121 | t746 = t24/t8/t743 + 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & | ^ -Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4179:22: +note: 't424' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3408:31: - 4179 | t922 = t78**2 - | ^ -Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4310:23: + 3408 | t383 = t42*omega + | ^ +Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:90: - 4310 | t1400 = t75**2 - | ^ -Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4145:67: + 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & + | ^ +note: 't42' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4405:65: - 4145 | + t772 - t806 + 0.10e2_dp/0.9e1_dp*t73*t258*t56*t58 - | ^ -Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4181:64: + 4405 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 + | ^ +Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:85: - 4181 | + t772 - t806 + 0.10e2_dp/0.9e1_dp*t72*t258*t231 - | ^ -Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3912:53: + 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & + | ^ +note: 't417' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: - 3912 | t320 = 2._dp*t288*t70 + t11*t302 - t249*t318 - | ^ -Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4116:34: + 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + | ^ +Warning: 't413' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:65: - 4116 | t721 = 6._dp*t11*t718*t69 - | ^ -Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4055:25: + 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & + | ^ +note: 't413' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3562:38: - 4055 | t595 = t68*ndrho - | ^ -Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3875:22: + 3562 | t747 = lambda*t41*omega + | ^ +Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:45: - 3875 | t250 = t67**2 - | ^ -Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: + 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & + | ^ +note: 't41' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4405:65: - 4173 | a5*t21*t54*t65 - | ^ -Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: + 4405 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 + | ^ +Warning: 't406' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:26: - 4141 | t63) - | ^ -Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3885:31: + 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & + | ^ +note: 't406' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3591:35: - 3885 | t274 = t60/t61/rho*t63 - | ^ -Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: + 3591 | *t49*t822*t14 + | ^ +Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:20: - 4141 | t63) - | ^ -Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: + 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & + | ^ +note: 't405' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4393:39: - 4173 | a5*t21*t54*t65 - | ^ -Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: + 4393 | *t400*t401*t2230 + | ^ +Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:75: - 4141 | t63) - | ^ -Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4123:26: + 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & + | ^ +note: 't401' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5221:38: - 4123 | t752 = t46*t31*t6 - | ^ -Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: + 5221 | t5643 = t400*t3975*t561 + | ^ +Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:69: - 4322 | *t199*t285 + t550*t285)) - | ^ -Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: + 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & + | ^ +note: 't400' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4420:41: - 4141 | t63) - | ^ -Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4197:33: + 4420 | t2992 = 0.1e1_dp/t1140/t40 + | ^ +Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:63: - 4197 | t1032 = t116*t251*t4*t44 - | ^ + 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & + | ^ +note: 't40' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3841:30: + + 3841 | t1409 = t4*t164 + | ^ Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:58: - 4141 | t63) - | ^ -Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3908:26: + 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & + | ^ +note: 't4' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4099:32: - 3908 | t313 = a5*t38*t54 - | ^ -Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: + 4099 | t1912 = t399*t245 + | ^ +Warning: 't399' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:54: - 4141 | t63) - | ^ -Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4215:25: + 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & + | ^ +note: 't399' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4498:31: - 4215 | t1124 = t34*t767 - | ^ -Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: + 4498 | t3278 = rho*t398 + | ^ +Warning: 't398' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:41: - 4173 | a5*t21*t54*t65 - | ^ -Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4124:28: + 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & + | ^ +note: 't398' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4366:104: - 4124 | t756 = t27*t266*t31 - | ^ -Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: + 4366 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 + | ^ +Warning: 't394' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3110:88: - 4128 | *t25*t756) - | ^ -Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4141:44: + 3110 | REAL(kind=dp) :: t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, t3940, & + | ^ +note: 't394' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4823:58: - 4141 | t63) - | ^ -Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4124:28: + 4823 | + 0.3333333334e0_dp*t165*t437*t1688 + | ^ +Warning: 't393' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3110:68: - 4124 | t756 = t27*t266*t31 - | ^ -Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: + 3110 | REAL(kind=dp) :: t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, t3940, & + | ^ +note: 't393' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4418:57: - 4128 | *t25*t756) - | ^ -Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4173:30: + 4418 | - 0.5000000001e0_dp*t429*t437*t914 + | ^ +Warning: 't392' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3110:55: - 4173 | a5*t21*t54*t65 - | ^ -Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4324:64: + 3110 | REAL(kind=dp) :: t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, t3940, & + | ^ +note: 't392' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3834:29: - 4324 | - t80*(t1189 + t1408)*Clda)*sx - | ^ -Warning: 't206' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: + 3834 | *t1397 + | ^ +Warning: 't387' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3109:74: - 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) - | ^ -Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4461:36: + 3109 | t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869, t387 + | ^ +note: 't387' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4508:66: - 4461 | - (4._dp*t568*t570) - | ^ -Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: + 4508 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 + | ^ +Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3109:26: - 4322 | *t199*t285 + t550*t285)) - | ^ -Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: Warning: 't193' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: + 3109 | t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869, t387 + | ^ +note: 't384' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5099:51: - 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) - | ^ -Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: + 5099 | t5335 = 0.2222222224e0_dp*t383*t5281 + | ^ +Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3109:20: - 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) - | ^ -Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4322:110: + 3109 | t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869, t387 + | ^ +note: 't383' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3834:29: - 4322 | *t199*t285 + t550*t285)) - | ^ -Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: + 3834 | *t1397 + | ^ +Warning: 't380' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:90: - 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) - | ^ -Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4289:26: + 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & + | ^ +note: 't380' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4508:66: - 4289 | t1331 = t166*t181 - | ^ -Warning: 't181' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: + 4508 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 + | ^ +Warning: 't379' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:70: - 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) + 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & + | ^ +note: 't379' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5205:42: + + 5205 | t5602 = 0.40e1_dp*t624*t376 + | ^ +Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:57: + + 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & | ^ -Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4406:26: +note: 't376' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4340:55: - 4406 | t1796 = t176*t177 - | ^ -Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4248:21: + 4340 | 0.5866666667e2_dp*t962*t949*t375 + | ^ +Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:44: - 4248 | *t58 - | ^ -Warning: 't174' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4487:68: + 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & + | ^ +note: 't375' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3972:48: - 4487 | *(t1989) - t151*t1979*t83*t159 + (2._dp*t1678*t635) - | ^ -Warning: 't170' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: + 3972 | t1662 = 0.3200000000e2_dp*t7*t372 + | ^ +Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:31: - 4128 | *t25*t756) - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4264:40: + 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & + | ^ +note: 't372' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: - 4264 | t1250 = 0.1e1_dp/t169/t156/t155 - | ^ -Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4429:71: + 4322 | *t2565*t796 + | ^ +Warning: 't371' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:18: - 4429 | *t461*t320) - (2._dp*t91*t344*t875) - | ^ -Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4393:26: + 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & + | ^ +note: 't371' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3490:61: - 4393 | t1737 = t166*t167 - | ^ -Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4404:124: + 3490 | t561 = 0.40e1_dp*t24*t37 - 0.20e1_dp*t102*t558 + | ^ +Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:12: - 4404 | *t471*t875)/0.2e1_dp + (10._dp*t1685*t1762) - | ^ -Warning: 't163' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4286:35: + 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & + | ^ +note: 't37' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: - 4286 | t1315 = 0.1e1_dp/t162/t155 - | ^ -Warning: 't162' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: + 4322 | *t2565*t796 + | ^ +Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:86: - 4128 | *t25*t756) - | ^ -Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4376:22: + 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & + | ^ +note: 't368' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3634:31: - 4376 | *t320 - | ^ -Warning: 't159' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4254:41: + 3634 | t942 = t367*t306 + | ^ +Warning: 't367' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:52: - 4254 | t1213 = 0.1e1_dp/t158/t1210/t155 - | ^ -Warning: 't158' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3985:34: + 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & + | ^ +note: 't367' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5164:38: - 3985 | t456 = 0.1e1_dp/t158/t157 + 5164 | t5496 = t366*t368*t1681 + | ^ +Warning: 't366' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:39: + + 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & + | ^ +note: 't366' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: + + 4322 | *t2565*t796 | ^ -Warning: 't157' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4396:32: +Warning: 't365' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:33: - 4396 | t1753 = t456*t156*t1687 - | ^ -Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4382:32: + 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & + | ^ +note: 't365' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3973:42: - 4382 | t1692 = t483*t155*t1687 - | ^ -Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4394:32: + 3973 | t1664 = 0.60e1_dp*t550*t362 + | ^ +Warning: 't362' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:27: - 4394 | t1739 = t483*t154*t1687 - | ^ -Warning: 't154' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4379:26: + 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & + | ^ +note: 't362' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: - 4379 | t1685 = t151*t152 - | ^ -Warning: 't152' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: + 4322 | *t2565*t796 + | ^ +Warning: 't360' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3106:93: - 4234 | *(t435)*(t437)*(t976) - | ^ -Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4474:58: + 3106 | t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, t360, & + | ^ +note: 't360' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3331:30: - 4474 | + 0.3e1_dp/0.2e1_dp*(t511)*(t516)*(t2064) - | ^ -Warning: 't149' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4281:26: + 3331 | t221 = t220*t36 + | ^ +Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3106:87: - 4281 | t1295 = t148*t968 - | ^ -Warning: 't148' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4250:31: + 3106 | t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, t360, & + | ^ +note: 't36' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: - 4250 | t1202 = t176*t147*t149 - | ^ -Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: + 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 + | ^ +Warning: 't357' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3106:54: - 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) - | ^ -Warning: 't145' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3974:25: + 3106 | t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, t360, & + | ^ +note: 't357' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3677:32: - 3974 | t435 = t141*t142 - | ^ -Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4328:132: + 3677 | t1002*rho + | ^ +Warning: 't356' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3106:34: - 4328 | - t561*t278 + 2._dp*t85*t855 - t85*t872) - | ^ -Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: + 3106 | t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, t360, & + | ^ +note: 't356' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3969:51: - 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) - | ^ -Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: + 3969 | t1656 = 0.8000000000e1_dp*t1429*t352 + | ^ +Warning: 't352' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3105:66: - 4356 | t419*t77*t871)/0.2e1_dp) - | ^ -Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: + 3105 | t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, t3546, & + | ^ +note: 't352' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: - 4234 | *(t435)*(t437)*(t976) - | ^ -Warning: 't131' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4356:132: + 4622 | *t786*t1034*t1681 + | ^ +Warning: 't350' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3105:18: - 4356 | t419*t77*t871)/0.2e1_dp) - | ^ -Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4494:106: + 3105 | t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, t3546, & + | ^ +note: 't350' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4331:40: - 4494 | t549*t199 - t690*t1401*t1620 + t691*t320) - | ^ -Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: + 4331 | t2585 = 0.1e1_dp/t972/t35 + | ^ +Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3105:12: - 4234 | *(t435)*(t437)*(t976) - | ^ -Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3961:30: + 3105 | t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, t3546, & + | ^ +note: 't35' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5159:51: - 3961 | t416 = t125*t126*t128 - | ^ -Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4206:25: + 5159 | t5484 = 0.1760000000e3_dp*t5460*t347 + | ^ +Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:65: - 4206 | t1068 = t96*t124 - | ^ -Warning: 't124' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: + 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & + | ^ +note: 't347' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3965:51: - 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) - | ^ -Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4338:116: + 3965 | t1647 = 0.5600000000e2_dp*t1645*t343 + | ^ +Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:45: - 4338 | *t388) + (2._dp*t374*t227*t592) - (4._dp*t596*t388) - | ^ -Warning: 't120' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3851:23: + 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & + | ^ +note: 't343' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: - 3851 | t216 = t12*rho - | ^ -Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4341:47: + 4613 | + 0.3200000000e2_dp*t1055*t3674 + | ^ +Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:39: - 4341 | + t1079*t210*t1080*t316) - | ^ -Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4203:65: + 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & + | ^ +note: 't342' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: - 4203 | t380*t705*t14*t383 + 0.6e1_dp*t118*t119*t718*t77 - | ^ -Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: + 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + | ^ +Warning: 't341' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:33: - 4450 | - 0.7e1_dp/0.2e1_dp*(t435)*(t437)*(t920) - | ^ -Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4450:57: Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3931:30: + 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & + | ^ +note: 't341' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 3931 | t364 = t109/t110/t361 - | ^ -Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4186:132: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:27: - 4186 | *t759*t68 - 2._dp*t335*t278 + 2._dp*t85*t769 - t85*t804)) - | ^ -Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4234:38: + 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & + | ^ +note: 't339' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3960:49: - 4234 | *(t435)*(t437)*(t976) - | ^ -Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:4128:83: + 3960 | t1638 = 0.1200000000e3_dp*t24*t336 + | ^ +Warning: 't336' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3103:69: - 4128 | *t25*t756) - | ^ -Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3898:24: + 3103 | REAL(kind=dp) :: t3344, t3347, t3352, t3353, t3356, t3357, t336, t3362, t3363, t3366, t3378, & + | ^ +note: 't336' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3974:76: - 3898 | t295 = t1*ndrho - | ^ -Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3535:89: + 3974 | t1667 = 0.28e2_dp/0.3e1_dp*t332 - 0.28e2_dp/0.3e1_dp*t987*rho + | ^ +Warning: 't332' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:67: - 3535 | t2274)*Clda)*sx - | ^ -Warning: 't920' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: + 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 + | ^ +note: 't332' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4519:73: - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) - | ^ -Warning: 't917' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: Warning: 't903' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: + 4519 | e_rho_rho_rho_spin(ii) = e_rho_rho_rho_spin(ii) + t3291*sx + | ^ +Warning: 't3291' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:40: - 3476 | - t852*t519 + f12*t2053*t94 - | ^ -Warning: 't886' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: + 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 + | ^ +note: 't3291' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3944:42: - 3453 | *t407) - | ^ -Warning: 't875' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: + 3944 | t1615 = 0.80e1_dp*t112*t329 + | ^ +Warning: 't329' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:33: - 3533 | - (5._dp*t1726*t506*t6*t407) - | ^ -Warning: 't860' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: + 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 + | ^ +note: 't329' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4340:55: - 3476 | - t852*t519 + f12*t2053*t94 - | ^ -Warning: 't852' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: + 4340 | 0.5866666667e2_dp*t962*t949*t375 + | ^ +Warning: 't328' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:20: - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) - | ^ -Warning: 't839' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: Warning: 't833' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 + | ^ +note: 't328' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4653:32: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't823' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: Warning: 't822' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: + 4653 | t3842 = t3278*t46 + | ^ +Warning: 't3278' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:14: - 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 - | ^ -Warning: 't816' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: Warning: 't813' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: + 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 + | ^ +note: 't3278' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4330:85: - 3476 | - t852*t519 + f12*t2053*t94 - | ^ -Warning: 't809' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: + 4330 | - 0.20e1_dp*t102*t105*t2569 - 0.6400000001e2_dp*t321*t953*t979 + | ^ +Warning: 't327' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:92: - 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) + 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & | ^ -Warning: 't805' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: Warning: 't802' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: Warning: 't796' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: Warning: 't793' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: - - 3533 | - (5._dp*t1726*t506*t6*t407) - | ^ -Warning: 't788' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: +note: 't327' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4704:32: - 3595 | /0.4e1_dp*t603*t1469*t2473 - | ^ -Warning: 't784' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3498:27: + 4704 | t4025 = t3262*t57 + | ^ +Warning: 't3262' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:72: - 3498 | t2136 = t1332*t783 - | ^ -Warning: 't783' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: + 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & + | ^ +note: 't3262' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3933:31: - 3595 | /0.4e1_dp*t603*t1469*t2473 - | ^ -Warning: 't781' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: + 3933 | t1598 = t326*rho + | ^ +Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:65: - 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) - | ^ -Warning: 't770' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3478:27: + 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & + | ^ +note: 't326' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4833:71: - 3478 | t2066 = t1262*t769 - | ^ -Warning: 't769' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: + 4833 | *t3507 - t3512)*t149*t160 + | ^ +Warning: 't3248' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:59: - 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) - | ^ -Warning: 't767' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: + 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & + | ^ +note: 't3248' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: - 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 - | ^ -Warning: 't761' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3477:26: + 4806 | *t1246*t3244*t1483 + | ^ +Warning: 't3244' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:52: - 3477 | t2060 = t759*t513 - | ^ -Warning: 't759' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3507:26: + 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & + | ^ +note: 't3244' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5192:51: - 3507 | t2180 = t136*t758 - | ^ -Warning: 't758' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3567:93: + 5192 | t5568 = 0.1066666667e2_dp*t1645*t322 + | ^ +Warning: 't322' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:38: - 3567 | t3*t19 + 12._dp*g3*t1*t24*t32) - | ^ -Warning: 't756' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: + 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & + | ^ +note: 't322' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5154:57: - 3459 | - (16._dp*t752*t331)) - | ^ -Warning: 't755' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't752' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't751' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't748' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't747' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: + 5154 | t5472 = 0.3200000001e2_dp*t321*t2455*t5079 + | ^ +Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:32: - 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 - | ^ -Warning: 't742' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: Warning: 't740' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3515:26: + 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & + | ^ +note: 't321' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3931:43: - 3515 | t2211 = t140*t739 - | ^ -Warning: 't739' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: + 3931 | t1596 = 0.320e2_dp*t605*t318 + | ^ +Warning: 't318' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:19: - 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) - | ^ -Warning: 't737' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: + 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & + | ^ +note: 't318' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4340:55: - 3471 | t404 - t733*t365 + 2._dp*t85*t1073 - t85*t1090) - | ^ -Warning: 't736' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: Warning: 't733' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3411:85: + 4340 | 0.5866666667e2_dp*t962*t949*t375 + | ^ +Warning: 't317' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:13: - 3411 | t727 - t80*(t1392 + t1517 + t1577 + t1742)*Clda)*sx - | ^ -Warning: 't727' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: + 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & + | ^ +note: 't317' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4340:55: - 3364 | *t58 - | ^ -Warning: 't723' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 4340 | 0.5866666667e2_dp*t962*t949*t375 + | ^ +Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:97: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't714' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: + 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & + | ^ +note: 't316' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5149:51: - 3409 | *t234*t1737*t452) - | ^ -Warning: 't710' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3385:26: + 5149 | t5462 = 0.1173333333e3_dp*t5460*t313 + | ^ +Warning: 't313' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:84: - 3385 | t1671 = t709*t160 - | ^ -Warning: 't709' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: + 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & + | ^ +note: 't313' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: - 3364 | *t58 - | ^ -Warning: 't705' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: + 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + | ^ +Warning: 't311' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:71: - 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 - | ^ -Warning: 't702' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: + 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & + | ^ +note: 't311' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3487:29: - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) - | ^ -Warning: 't699' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: + 3487 | t551 = t27*t31 + | ^ +Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:65: - 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 - | ^ -Warning: 't697' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: Warning: 't695' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: + 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & + | ^ +note: 't31' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: - 3476 | - t852*t519 + f12*t2053*t94 - | ^ -Warning: 't692' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: + 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 + | ^ +Warning: 't3097' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:53: - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) + 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & | ^ -Warning: 't689' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: +note: 't3097' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3662:40: - 3409 | *t234*t1737*t452) - | ^ -Warning: 't687' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: + 3662 | t1002 = 0.1e1_dp/t19/t309 + | ^ +Warning: 't309' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:39: - 3364 | *t58 - | ^ -Warning: 't681' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: Warning: 't679' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: + 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & + | ^ +note: 't309' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3672:31: - 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 - | ^ -Warning: 't671' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3247:26: + 3672 | t1033 = t308*t12 + | ^ +Warning: 't308' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:26: - 3247 | t1186 = t670*t186 + 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & | ^ -Warning: 't670' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: - - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) - | ^ -Warning: 't665' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: Warning: 't660' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - - 3409 | *t234*t1737*t452) - | ^ -Warning: 't659' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: +note: 't308' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5207:56: - 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) - | ^ -Warning: 't658' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: + 5207 | t5607 = 0.5866666667e2_dp*t307*t949*t5069 + | ^ +Warning: 't307' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:13: - 3409 | *t234*t1737*t452) - | ^ -Warning: 't656' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: + 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & + | ^ +note: 't307' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3630:31: - 3453 | *t407) - | ^ -Warning: 't652' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: + 3630 | t929 = t306*t311 + | ^ +Warning: 't306' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:85: - 3348 | (4._dp*t510*t552) - | ^ -Warning: 't650' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: + 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & + | ^ +note: 't306' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: - 3409 | *t234*t1737*t452) - | ^ -Warning: 't644' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: + 4737 | *t478*t183*t3918 + | ^ +Warning: 't3030' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:79: - 3348 | (4._dp*t510*t552) - | ^ -Warning: 't641' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: + 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & + | ^ +note: 't3030' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 3409 | *t234*t1737*t452) - | ^ -Warning: 't638' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't302' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:65: - 3453 | *t407) - | ^ -Warning: 't635' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: + 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & + | ^ +note: 't302' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: - 3533 | - (5._dp*t1726*t506*t6*t407) - | ^ -Warning: 't634' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: + 4737 | *t478*t183*t3918 + | ^ +Warning: 't2998' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:59: - 3409 | *t234*t1737*t452) - | ^ -Warning: 't633' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: + 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & + | ^ +note: 't2998' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: - 3453 | *t407) - | ^ -Warning: 't629' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3351:26: + 4737 | *t478*t183*t3918 + | ^ +Warning: 't2994' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:52: - 3351 | t1545 = t628*t238 - | ^ -Warning: 't628' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & + | ^ +note: 't2994' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5550:29: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't626' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: + 5550 | *t6271 + | ^ +Warning: 't2992' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:45: - 3453 | *t407) - | ^ -Warning: 't622' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: + 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & + | ^ +note: 't2992' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3921:49: - 3364 | *t58 - | ^ -Warning: 't620' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: + 3921 | t1579 = 0.1173333333e3_dp*t24*t299 + | ^ +Warning: 't299' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:38: - 3453 | *t407) - | ^ -Warning: 't615' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: + 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & + | ^ +note: 't299' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3932:30: - 3364 | *t58 - | ^ -Warning: 't612' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3496:32: + 3932 | t1597 = t7*t298 + | ^ +Warning: 't298' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:32: - 3496 | *(t607)*(t2111) + 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & | ^ -Warning: 't608' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: +note: 't298' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3834:29: - 3595 | /0.4e1_dp*t603*t1469*t2473 - | ^ -Warning: 't607' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3496:32: + 3834 | *t1397 + | ^ +Warning: 't295' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:26: - 3496 | *(t607)*(t2111) - | ^ -Warning: 't605' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3339:60: + 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & + | ^ +note: 't295' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: - 3339 | *t1333) - | ^ -Warning: 't604' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: + 4516 | + t3288) + | ^ +Warning: 't294' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:20: - 3595 | /0.4e1_dp*t603*t1469*t2473 - | ^ -Warning: 't603' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3339:60: + 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & + | ^ +note: 't294' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4823:58: - 3339 | *t1333) - | ^ -Warning: 't596' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: + 4823 | + 0.3333333334e0_dp*t165*t437*t1688 + | ^ +Warning: 't2937' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:14: - 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 - | ^ -Warning: 't595' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3339:60: + 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & + | ^ +note: 't2937' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4508:66: - 3339 | *t1333) - | ^ -Warning: 't591' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: + 4508 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 + | ^ +Warning: 't290' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:88: - 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 - | ^ -Warning: 't588' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3327:85: + 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & + | ^ +note: 't290' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5428:38: - 3327 | *t1430*t1151) - t1434*t1435*t452 - | ^ -Warning: 't587' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: + 5428 | t6181 = t289*t1564*t593 + | ^ +Warning: 't289' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:82: - 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 - | ^ -Warning: 't585' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3327:85: + 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & + | ^ +note: 't289' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5115:39: - 3327 | *t1430*t1151) - t1434*t1435*t452 - | ^ -Warning: 't584' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: + 5115 | t5373 = t2885*t446*t5371 + | ^ +Warning: 't2885' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:76: - 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) - | ^ -Warning: 't583' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: + 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & + | ^ +note: 't2885' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: - 3348 | (4._dp*t510*t552) + 4695 | t1320*t1483 | ^ -Warning: 't577' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3413:26: - - 3413 | t1768 = t569*t407 - | ^ -Warning: 't569' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: - - 3409 | *t234*t1737*t452) - | ^ -Warning: 't566' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: Warning: 't565' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: Warning: 't561' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3390:26: +Warning: 't2873' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:62: - 3390 | t1732 = t558*t513 - | ^ -Warning: 't558' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: + 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & + | ^ +note: 't2873' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3838:106: - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) - | ^ -Warning: 't552' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: + 3838 | t804 - 0.4444444448e0_dp*t43*t894 + t8*t1401)*sx + | ^ +Warning: 't283' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:27: - 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 - | ^ -Warning: 't551' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: + 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & + | ^ +note: 't283' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4682:40: - 3348 | (4._dp*t510*t552) - | ^ -Warning: 't549' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3538:27: + 4682 | *t400*t1333*t1410 + | ^ +Warning: 't2823' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:21: - 3538 | t2283 = t541*t1139 - | ^ -Warning: 't541' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3381:69: + 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & + | ^ +note: 't2823' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5481:36: - 3381 | - 0.3e1_dp/0.4e1_dp*t243*t1159 + t243*t1162/0.2e1_dp - | ^ -Warning: 't536' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3467:44: + 5481 | t5011 + t5001 + | ^ +Warning: 't2821' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:14: - 3467 | t1785 + t243*t1788/0.2e1_dp - | ^ -Warning: 't535' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3417:26: + 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & + | ^ +note: 't2821' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: - 3417 | t1791 = t531*t407 - | ^ -Warning: 't531' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3381:69: + 4516 | + t3288) + | ^ +Warning: 't282' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:94: - 3381 | - 0.3e1_dp/0.4e1_dp*t243*t1159 + t243*t1162/0.2e1_dp - | ^ -Warning: 't530' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3381:69: Warning: 't524' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3387:30: + 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & + | ^ +note: 't282' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4682:40: - 3387 | t1691 = 0.1e1_dp/t523 - | ^ -Warning: 't523' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3371:26: + 4682 | *t400*t1333*t1410 + | ^ +Warning: 't2808' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:81: - 3371 | t1619 = t522*t220 - | ^ -Warning: 't522' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3476:44: + 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & + | ^ +note: 't2808' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: - 3476 | - t852*t519 + f12*t2053*t94 - | ^ -Warning: 't519' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: + 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + | ^ +Warning: 't278' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:67: - 3533 | - (5._dp*t1726*t506*t6*t407) - | ^ -Warning: 't516' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: + 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & + | ^ +note: 't278' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5118:59: - 3409 | *t234*t1737*t452) - | ^ -Warning: 't514' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3477:26: + 5118 | t5383 = 0.4166666667e-1_dp*t2763*t1247*t5002 + | ^ +Warning: 't2763' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:54: - 3477 | t2060 = t759*t513 - | ^ -Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3235:34: + 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & + | ^ +note: 't2763' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4463:34: - 3235 | t1149 = 0.1e1_dp/t512/t82 + 4463 | *t503*t2312 | ^ -Warning: 't512' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: +Warning: 't275' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:40: - 3453 | *t407) - | ^ -Warning: 't510' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: + 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & + | ^ +note: 't275' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4580:33: - 3533 | - (5._dp*t1726*t506*t6*t407) - | ^ -Warning: 't507' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: Warning: 't506' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: + 4580 | t3569 = t274*t1505 + | ^ +Warning: 't274' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:34: - 3348 | (4._dp*t510*t552) + 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & | ^ -Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: - - 3364 | *t58 - | ^ -Warning: 't503' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: Warning: 't496' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: - - 3533 | - (5._dp*t1726*t506*t6*t407) - | ^ -Warning: 't491' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: +note: 't274' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: - 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 - | ^ -Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: + 4806 | *t1246*t3244*t1483 + | ^ +Warning: 't2720' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:14: - 3409 | *t234*t1737*t452) - | ^ -Warning: 't487' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3296:39: + 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & + | ^ +note: 't2720' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4450:69: - 3296 | *(t474)*(t481)*(t1351) - | ^ -Warning: 't483' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3281:27: + 4450 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 + | ^ +Warning: 't271' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:91: - 3281 | t1333 = t1332*t482 - | ^ -Warning: 't482' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: + 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & + | ^ +note: 't271' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: - 3595 | /0.4e1_dp*t603*t1469*t2473 - | ^ -Warning: 't481' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: + 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 + | ^ +Warning: 't2707' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:85: - 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) - | ^ -Warning: 't480' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3521:65: + 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & + | ^ +note: 't2707' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3487:29: - 3521 | *t2072 + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2111) - | ^ -Warning: 't476' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3339:60: + 3487 | t551 = t27*t31 + | ^ +Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:78: - 3339 | *t1333) - | ^ -Warning: 't475' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3296:39: + 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & + | ^ +note: 't27' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: - 3296 | *(t474)*(t481)*(t1351) - | ^ -Warning: 't474' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3330:26: + 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + | ^ +Warning: 't268' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:73: - 3330 | t1453 = t125*t470 - | ^ -Warning: 't470' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: + 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & + | ^ +note: 't268' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: - 3471 | t404 - t733*t365 + 2._dp*t85*t1073 - t85*t1090) - | ^ -Warning: 't468' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3276:132: + 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + | ^ +Warning: 't267' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:67: - 3276 | *t979*t68 - 2._dp*t464*t365 + 2._dp*t85*t989 - t85*t1022)) - | ^ -Warning: 't467' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: + 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & + | ^ +note: 't267' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4450:69: - 3471 | t404 - t733*t365 + 2._dp*t85*t1073 - t85*t1090) - | ^ -Warning: 't464' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: Warning: 't461' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: Warning: 't458' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3276:132: + 4450 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 + | ^ +Warning: 't266' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:61: - 3276 | *t979*t68 - 2._dp*t464*t365 + 2._dp*t85*t989 - t85*t1022)) - | ^ -Warning: 't457' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3296:39: + 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & + | ^ +note: 't266' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: - 3296 | *(t474)*(t481)*(t1351) + 4851 | *t289*t294*t1553 | ^ -Warning: 't454' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: +Warning: 't2636' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:35: - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) - | ^ -Warning: 't453' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: + 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & + | ^ +note: 't2636' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: - 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 - | ^ -Warning: 't452' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: + 4859 | *t83*t45*t3581*t140 + | ^ +Warning: 't2631' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:80: - 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) - | ^ -Warning: 't448' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3486:32: + 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 + | ^ +note: 't2631' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4058:32: - 3486 | t2099 = t447*t127*t2071 + 4058 | t1821 = t472*t262 | ^ -Warning: 't447' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3514:70: +Warning: 't262' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:59: - 3514 | t2195*t2099 + 0.5e1_dp/0.2e1_dp*(t440)*(t448)*(t1946) - | ^ -Warning: 't443' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: + 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 + | ^ +note: 't262' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5143:57: - 3533 | - (5._dp*t1726*t506*t6*t407) - | ^ -Warning: 't442' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: Warning: 't441' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3296:39: + 5143 | t5449 = 0.1173333333e3_dp*t307*t2611*t5065 + | ^ +Warning: 't2611' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:53: - 3296 | *(t474)*(t481)*(t1351) - | ^ -Warning: 't440' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3316:26: + 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 + | ^ +note: 't2611' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5248:73: - 3316 | t1407 = t110*t436 - | ^ -Warning: 't436' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: + 5248 | t5716 = 0.1620000000e3_dp*t4994*t392*t4769*t1141*t26*t5713 + | ^ +Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:40: - 3459 | - (16._dp*t752*t331)) - | ^ -Warning: 't434' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: + 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 + | ^ +note: 't26' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4630:33: - 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) - | ^ -Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: 't423' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: + 4630 | t3750 = t2585*t136 + | ^ +Warning: 't2585' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:35: - 3459 | - (16._dp*t752*t331)) + 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 + | ^ +note: 't2585' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5172:67: + + 5172 | *t5511 + 0.1200000000e3_dp*t1055*t2565*t4721 | ^ -Warning: 't420' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: +Warning: 't2565' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:14: - 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) - | ^ -Warning: 't416' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: + 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 + | ^ +note: 't2565' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4604:32: - 3533 | - (5._dp*t1726*t506*t6*t407) - | ^ -Warning: 't413' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3535:89: + 4604 | t3668 = t2552*t23 + | ^ +Warning: 't2552' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:93: - 3535 | t2274)*Clda)*sx - | ^ -Warning: 't409' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: + 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & + | ^ +note: 't2552' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: - 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 - | ^ -Warning: 't407' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3232:46: + 4613 | + 0.3200000000e2_dp*t1055*t3674 + | ^ +Warning: 't2537' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:86: - 3232 | *t303*t1119 - t338*t303*t1136 - | ^ -Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: + 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & + | ^ +note: 't2537' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: - 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) - | ^ -Warning: 't404' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: + 5005 | + t5032 + t5035 + | ^ +Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:79: - 3222 | *t303*t1073 - t338*t303*t1090 - | ^ -Warning: 't403' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: + 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & + | ^ +note: 't250' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3479:26: - 3216 | *t355) - (48._dp*t400*t361)) - | ^ -Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: 't396' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: 't395' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: 't392' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: 't391' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3232:46: + 3479 | t537 + | ^ +Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:73: - 3232 | *t303*t1119 - t338*t303*t1136 - | ^ -Warning: 't389' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: + 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & + | ^ +note: 't25' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4927:59: - 3222 | *t303*t1073 - t338*t303*t1090 - | ^ -Warning: 't388' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3209:25: + 4927 | - 0.2400000000e2_dp*t786/t2492*t1058 + | ^ +Warning: 't2492' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:68: - 3209 | t1034 = t14*t387 - | ^ -Warning: 't387' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3211:73: + 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & + | ^ +note: 't2492' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4295:40: - 3211 | - 0.16e2_dp/0.3e1_dp*t383*t324*t327 - (16._dp*t384*t331) - | ^ -Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3211:73: Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: + 4295 | *t1368*t166*t2160 + | ^ +Warning: 't249' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:61: - 3229 | + 30._dp*a5*t21*t54*t65) - | ^ -Warning: 't382' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3211:73: + 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & + | ^ +note: 't249' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: - 3211 | - 0.16e2_dp/0.3e1_dp*t383*t324*t327 - (16._dp*t384*t331) - | ^ -Warning: 't379' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3211:73: Warning: 't378' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: + 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + | ^ +Warning: 't2480' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:55: - 3222 | *t303*t1073 - t338*t303*t1090 - | ^ -Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3212:25: + 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & + | ^ +note: 't2480' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: - 3212 | t1067 = t374*t18 - | ^ -Warning: 't374' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3467:44: + 4629 | *t321*t953*t1625 + | ^ +Warning: 't2468' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:48: - 3467 | t1785 + t243*t1788/0.2e1_dp - | ^ -Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: + 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & + | ^ +note: 't2468' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5154:57: - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) - | ^ -Warning: 't369' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: + 5154 | t5472 = 0.3200000001e2_dp*t321*t2455*t5079 + | ^ +Warning: 't2455' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:41: - 3222 | *t303*t1073 - t338*t303*t1090 - | ^ -Warning: 't366' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3471:93: + 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & + | ^ +note: 't2455' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4099:32: - 3471 | t404 - t733*t365 + 2._dp*t85*t1073 - t85*t1090) - | ^ -Warning: 't365' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3213:31: + 4099 | t1912 = t399*t245 + | ^ +Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:27: - 3213 | t1073 = t987*t364*t403 - | ^ -Warning: 't364' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: + 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & + | ^ +note: 't245' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: - 3216 | *t355) - (48._dp*t400*t361)) - | ^ -Warning: 't361' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: Warning: 't355' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: + 4851 | *t289*t294*t1553 + | ^ +Warning: 't2404' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:79: - 3202 | /t12*t63)) - | ^ -Warning: 't353' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: + 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & + | ^ +note: 't2404' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3387:30: - 3216 | *t355) - (48._dp*t400*t361)) - | ^ -Warning: 't349' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: + 3387 | t350 = t24*t225 + | ^ +Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:72: - 3202 | /t12*t63)) - | ^ -Warning: 't348' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3216:132: + 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & + | ^ +note: 't24' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: - 3216 | *t355) - (48._dp*t400*t361)) - | ^ -Warning: 't346' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: + 4516 | + t3288) + | ^ +Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:46: - 3202 | /t12*t63)) - | ^ -Warning: 't341' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: + 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & + | ^ +note: 't237' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3924:44: - 3229 | + 30._dp*a5*t21*t54*t65) - | ^ -Warning: 't340' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3194:33: + 3924 | t1584 = 0.320e2_dp*t1582*t234 + | ^ +Warning: 't234' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:26: - 3194 | t987 = 0.1e1_dp/t339/t67 - | ^ -Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3203:32: + 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & + | ^ +note: 't234' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4330:85: - 3203 | t1024 = t338*t303*t1022 - | ^ -Warning: 't338' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: + 4330 | - 0.20e1_dp*t102*t105*t2569 - 0.6400000001e2_dp*t321*t953*t979 + | ^ +Warning: 't233' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:20: - 3222 | *t303*t1073 - t338*t303*t1090 - | ^ -Warning: 't336' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3178:35: + 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & + | ^ +note: 't233' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3855:53: - 3178 | t950 = 4._dp*t11*t311*t335 - | ^ -Warning: 't335' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3171:24: + 3855 | + 0.8000000000e1_dp*t366*t1440 + | ^ +Warning: 't230' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3092:46: - 3171 | t933 = t14*t334 - | ^ -Warning: 't334' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: + 3092 | t2292, t2295, t2296, t2299, t23, t230, t2300, t2304, t2307, t2308, t2311, t2312, t2319, & + | ^ +note: 't230' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3945:29: - 3459 | - (16._dp*t752*t331)) - | ^ -Warning: 't331' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't327' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3186:25: + 3945 | t1616 = t7*t23 + | ^ +Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3092:40: - 3186 | t968 = t326*t275 - | ^ -Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: + 3092 | t2292, t2295, t2296, t2299, t23, t230, t2300, t2304, t2307, t2308, t2311, t2312, t2319, & + | ^ +note: 't23' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4422:31: - 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) - | ^ -Warning: 't325' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: + 4422 | t2998 = t27*t225 + | ^ +Warning: 't225' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:87: - 3459 | - (16._dp*t752*t331)) - | ^ -Warning: 't324' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3179:23: + 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & + | ^ +note: 't225' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3659:40: - 3179 | t951 = t4*t320 - | ^ -Warning: 't320' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: + 3659 | t995 = 0.1e1_dp/t787/t224 + | ^ +Warning: 't224' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:81: - 3459 | - (16._dp*t752*t331)) - | ^ -Warning: 't317' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: + 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & + | ^ +note: 't224' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: - 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) - | ^ -Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: + 4622 | *t786*t1034*t1681 + | ^ +Warning: 't2220' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:54: - 3459 | - (16._dp*t752*t331)) - | ^ -Warning: 't315' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: + 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & + | ^ +note: 't2220' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3859:28: - 3222 | *t303*t1073 - t338*t303*t1090 - | ^ -Warning: 't312' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: + 3859 | t1444 + | ^ +Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:47: - 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) - | ^ -Warning: 't311' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3169:27: + 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & + | ^ +note: 't221' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: - 3169 | t930 = t4*t44*t310 - | ^ -Warning: 't310' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: + 4322 | *t2565*t796 + | ^ +Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:13: - 3202 | /t12*t63)) - | ^ -Warning: 't309' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: + 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & + | ^ +note: 't220' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3377:30: - 3222 | *t303*t1073 - t338*t303*t1090 - | ^ -Warning: 't306' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: Warning: 't305' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3197:36: + 3377 | t327 = t22*t326 + | ^ +Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:93: - 3197 | t992 = 2._dp*t338*t303*t989 - | ^ -Warning: 't303' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3222:46: + 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & + | ^ +note: 't22' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3657:31: - 3222 | *t303*t1073 - t338*t303*t1090 - | ^ -Warning: 't302' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3208:26: + 3657 | t987 = t219*t341 + | ^ +Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:60: - 3208 | t1031 = t374*t301 - | ^ -Warning: 't301' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: + 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & + | ^ +note: 't219' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: - 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) - | ^ -Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: 't96' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3521:65: + 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + | ^ +Warning: 't2182' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:40: - 3521 | *t2072 + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2111) - | ^ -Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: + 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & + | ^ +note: 't2182' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: - 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 - | ^ -Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: + 4322 | *t2565*t796 + | ^ +Warning: 't218' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:33: - 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) - | ^ -Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3007:22: + 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & + | ^ +note: 't218' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4936:42: - 3007 | t512 = t92**2 - | ^ -Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: + 4936 | t4864 = t217*t46*t1535*t561 + | ^ +Warning: 't217' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:27: - 3409 | *t234*t1737*t452) - | ^ -Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3279:30: + 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & + | ^ +note: 't217' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4873:56: - 3279 | t1331 = t140*t90*t108 - | ^ -Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: + 4873 | t4704 = 0.3333333336e0_dp*t2147*t84*t4701 + | ^ +Warning: 't2147' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3088:55: - 3364 | *t58 - | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: + 3088 | t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160, t2169 + | ^ +note: 't2147' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4908:55: - 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) - | ^ -Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3276:132: + 4908 | t4789 = 0.4444444448e0_dp*t214*t46*t4786 + | ^ +Warning: 't214' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3088:41: - 3276 | *t979*t68 - 2._dp*t464*t365 + 2._dp*t85*t989 - t85*t1022)) - | ^ -Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: + 3088 | t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160, t2169 + | ^ +note: 't214' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5510:79: - 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) - | ^ -Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: + 5510 | *t6181 - t6185 + t6189 - t6192 - 0.3333333336e0_dp*t6194 + | ^ +Warning: 't2139' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3088:35: - 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 - | ^ -Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: + 3088 | t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160, t2169 + | ^ +note: 't2139' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5525:90: - 3595 | /0.4e1_dp*t603*t1469*t2473 - | ^ -Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3235:34: + 5525 | t5418 + 0.1800000000e2_dp*t658*t575*t2074 + 0.1800000000e2_dp*t5421 + | ^ +Warning: 't2131' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3088:21: - 3235 | t1149 = 0.1e1_dp/t512/t82 - | ^ -Warning: 't82' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3614:71: + 3088 | t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160, t2169 + | ^ +note: 't2131' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5562:82: - 3614 | e_ndrho_ndrho = e_ndrho_ndrho + (-t80*(t2391 + t2668)*Clda)*sx - | ^ -Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: + 5562 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 + | ^ +Warning: 't2126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:91: - 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 - | ^ -Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3234:23: + 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + | ^ +note: 't2126' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5582:46: - 3234 | t1141 = t78**2 - | ^ -Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3418:30: + 5582 | *t60*t2124*t709 - t6044 + | ^ +Warning: 't2124' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:84: - 3418 | t1795 = t75*t372*t407 - | ^ -Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3206:62: + 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + | ^ +note: 't2124' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5562:82: - 3206 | + t992 - t1024 + 0.10e2_dp/0.9e1_dp*t73*t1026 - | ^ -Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: + 5562 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 + | ^ +Warning: 't2118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:77: - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) - | ^ -Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2957:53: + 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + | ^ +note: 't2118' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5566:41: - 2957 | t407 = 2._dp*t375*t70 + t11*t389 - t338*t405 - | ^ -Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3177:34: + 5566 | *t5228*t2117*t2028 + | ^ +Warning: 't2117' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:70: - 3177 | t947 = 6._dp*t11*t944*t69 - | ^ -Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3544:115: + 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + | ^ +note: 't2117' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5562:82: - 3544 | *t68 - 2._dp*t733*t404 + 2._dp*t85*t1119 - t85*t1136) - | ^ -Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2921:22: + 5562 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 + | ^ +Warning: 't2114' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:63: - 2921 | t339 = t67**2 - | ^ -Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: + 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + | ^ +note: 't2114' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5582:46: - 3229 | + 30._dp*a5*t21*t54*t65) - | ^ -Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: + 5582 | *t60*t2124*t709 - t6044 + | ^ +Warning: 't2113' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:56: - 3202 | /t12*t63)) - | ^ -Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2930:31: + 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + | ^ +note: 't2113' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5572:60: - 2930 | t361 = t60/t61/rho*t63 - | ^ -Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: + 5572 | t6260 + 0.8999999998e1_dp*t5229*t2104 + | ^ +Warning: 't2104' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:42: - 3202 | /t12*t63)) - | ^ -Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: + 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + | ^ +note: 't2104' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5550:29: - 3229 | + 30._dp*a5*t21*t54*t65) - | ^ -Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: + 5550 | *t6271 + | ^ +Warning: 't2099' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:35: - 3202 | /t12*t63)) - | ^ -Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3187:26: + 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + | ^ +note: 't2099' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5566:41: - 3187 | t972 = t46*t31*t6 - | ^ -Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: + 5566 | *t5228*t2117*t2028 + | ^ +Warning: 't2098' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:28: - 3409 | *t234*t1737*t452) - | ^ -Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: + 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + | ^ +note: 't2098' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5562:82: - 3202 | /t12*t63)) - | ^ -Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3179:23: + 5562 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 + | ^ +Warning: 't2095' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:21: - 3179 | t951 = t4*t320 - | ^ -Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: + 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + | ^ +note: 't2095' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: - 3202 | /t12*t63)) - | ^ -Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2953:26: + 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) + | ^ +Warning: 't2088' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:14: - 2953 | t400 = a5*t38*t54 - | ^ -Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: + 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + | ^ +note: 't2088' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: - 3202 | /t12*t63)) - | ^ -Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3202:67: Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3174:24: + 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) + | ^ +Warning: 't2082' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:90: - 3174 | t939 = t34*t340 - | ^ -Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3567:93: + 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & + | ^ +note: 't2082' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5540:38: - 3567 | t3*t19 + 12._dp*g3*t1*t24*t32) - | ^ -Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3188:28: + 5540 | - t6090 + t6094 + | ^ +Warning: 't2081' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:83: - 3188 | t976 = t27*t353*t31 - | ^ -Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3411:85: + 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & + | ^ +note: 't2081' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: - 3411 | t727 - t80*(t1392 + t1517 + t1577 + t1742)*Clda)*sx - | ^ -Warning: 't299' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) + | ^ +Warning: 't2077' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:76: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't296' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: + 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & + | ^ +note: 't2077' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5525:90: - 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 - | ^ -Warning: 't295' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: + 5525 | t5418 + 0.1800000000e2_dp*t658*t575*t2074 + 0.1800000000e2_dp*t5421 + | ^ +Warning: 't2074' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:69: - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) - | ^ -Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3081:25: + 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & + | ^ +note: 't2074' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: - 3081 | t681 = t292*t293 - | ^ -Warning: 't292' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: + 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 + | ^ +Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:55: - 3348 | (4._dp*t510*t552) - | ^ -Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: + 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & + | ^ +note: 't207' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5511:33: - 3409 | *t234*t1737*t452) - | ^ -Warning: 't284' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: + 5511 | t6400 = t2061*t561 + | ^ +Warning: 't2061' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:49: - 3348 | (4._dp*t510*t552) - | ^ -Warning: 't282' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3302:32: + 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & + | ^ +note: 't2061' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5503:78: - 3302 | t1385 = t1382*t1383*t28 - | ^ -Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 5503 | - t5595 + t5597 - t5600 - t5602 + t5604 + t5607 + t5610 + | ^ +Warning: 't2058' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:42: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't279' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3256:29: + 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & + | ^ +note: 't2058' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5493:79: - 3256 | t1243 = t278*t56*t58 - | ^ -Warning: 't278' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: + 5493 | *t327*t2057*t557 - t5456 + t5459 - t5462 + t5466 - t5468 + | ^ +Warning: 't2057' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:35: - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) - | ^ -Warning: 't274' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3086:25: + 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & + | ^ +note: 't2057' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5497:40: - 3086 | t695 = t273*t274 - | ^ -Warning: 't273' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3188:28: + 5497 | *t1054*t640*t3679 + | ^ +Warning: 't2054' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:28: - 3188 | t976 = t27*t353*t31 + 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & | ^ -Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3373:38: +note: 't2054' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5597:132: - 3373 | t1630 = f2732/t258/t1626/t213 - | ^ -Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3388:25: + 5597 | + t6442 + t6451 + t6461 + t6479 + t6490 + t6499 + t6658) + | ^ +Warning: 't2050' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:21: - 3388 | t1699 = f94/t257 - | ^ -Warning: 't257' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3155:58: + 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & + | ^ +note: 't2050' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5601:73: - 3155 | *t862/0.2e1_dp) + t270*t830)*alpha7 - | ^ -Warning: 't256' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3368:41: + 5601 | t43*t46*t6339 + t8*(t6344 + t6380 + t6389 + t6665) + | ^ +Warning: 't2046' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:14: - 3368 | t1613 = 0.1e1_dp/t253/t1178/t523 - | ^ -Warning: 't253' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3012:34: + 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & + | ^ +note: 't2046' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5536:63: - 3012 | t522 = 0.1e1_dp/t253/t252 - | ^ -Warning: 't252' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: + 5536 | *t575*t161*t1447 + t5773 + t5776 + t5780 + | ^ +Warning: 't2042' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:97: - 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) - | ^ -Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: + 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & + | ^ +note: 't2042' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: - 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 - | ^ -Warning: 't249' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3348:34: + 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) + | ^ +Warning: 't2035' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:90: - 3348 | (4._dp*t510*t552) - | ^ -Warning: 't248' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: + 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & + | ^ +note: 't2035' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5582:46: - 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 - | ^ -Warning: 't247' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: Warning: 't239' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 5582 | *t60*t2124*t709 - t6044 + | ^ +Warning: 't2032' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:83: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't238' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3350:25: + 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & + | ^ +note: 't2032' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5515:46: - 3350 | t1538 = t75*t236 - | ^ -Warning: 't236' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: + 5515 | *t27*t6291*t172 - t5397 + | ^ +Warning: 't2031' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:76: - 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 - | ^ -Warning: 't234' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3063:25: + 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & + | ^ +note: 't2031' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3438:30: - 3063 | t633 = t233*t154 - | ^ -Warning: 't233' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3245:41: + 3438 | t466 = t27*t203 + | ^ +Warning: 't203' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:69: - 3245 | t1181 = 0.1e1_dp/t221/t1178/t185 + 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & + | ^ +note: 't203' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5566:41: + + 5566 | *t5228*t2117*t2028 | ^ -Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3467:44: +Warning: 't2028' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:63: - 3467 | t1785 + t243*t1788/0.2e1_dp - | ^ -Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: + 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & + | ^ +note: 't2028' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5550:29: - 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) - | ^ -Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3384:27: + 5550 | *t6271 + | ^ +Warning: 't2027' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:56: - 3384 | t1667 = t1666*t219 - | ^ -Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3242:40: + 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & + | ^ +note: 't2027' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: - 3242 | t1167 = 0.1e1_dp/t215/t256/t213 - | ^ -Warning: 't215' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3381:69: + 5005 | + t5032 + t5035 + | ^ +Warning: 't2022' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:49: - 3381 | - 0.3e1_dp/0.4e1_dp*t243*t1159 + t243*t1162/0.2e1_dp - | ^ -Warning: 't214' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: + 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & + | ^ +note: 't2022' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: - 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 - | ^ -Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3559:107: + 5488 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't2018' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:42: - 3559 | *t1139 - t243*t2336)*alpha6*t247*t249 - | ^ -Warning: 't210' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3229:47: + 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & + | ^ +note: 't2018' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: - 3229 | + 30._dp*a5*t21*t54*t65) - | ^ -Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2998:25: + 5488 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't2014' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:35: - 2998 | t489 = t209*t153 - | ^ -Warning: 't209' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & + | ^ +note: 't2014' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't204' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: Warning: 't202' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: + 5488 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't2013' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:28: - 3364 | *t58 + 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & + | ^ +note: 't2013' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: + + 5488 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't2009' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:21: + + 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & | ^ -Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3238:35: +note: 't2009' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4667:32: - 3238 | t1157 = 0.1e1_dp/t190/t213 - | ^ -Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3114:47: + 4667 | t3875 = t45*t2002 + | ^ +Warning: 't2002' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:94: - 3114 | t755 = 2._dp*t748*t19 + 4._dp*t752*t32 - | ^ -Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3383:35: + 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & + | ^ +note: 't2002' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3549:87: - 3383 | t1666 = 0.1e1_dp/t187/t523 - | ^ -Warning: 't187' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: + 3549 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 + | ^ +Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:73: - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) - | ^ -Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3092:25: + 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & + | ^ +note: 't200' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4127:31: - 3092 | t710 = t709*t185 - | ^ -Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3090:24: + 4127 | t1972 = t177*t20 + | ^ +Warning: 't20' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:67: - 3090 | t705 = t182*t72 - | ^ -Warning: 't182' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3212:25: + 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & + | ^ +note: 't20' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3465:31: - 3212 | t1067 = t374*t18 - | ^ -Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 3465 | t534 = t199*t267 + | ^ +Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:41: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3089:26: + 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & + | ^ +note: 't199' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5250:56: - 3089 | t702 = t176*omega - | ^ -Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: + 5250 | t5722 = 0.1111111111e0_dp*t165*t689*t1988 + | ^ +Warning: 't1988' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:35: - 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3000:30: + 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & + | ^ +note: 't1988' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4798:66: - 3000 | t496 = t166/t167/t160 - | ^ -Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 4798 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 + | ^ +Warning: 't1981' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:14: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't161' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3191:64: + 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & + | ^ +note: 't1981' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5129:43: - 3191 | 0.32e2_dp/0.3e1_dp*t325*t972 + (20._dp*t25*t976) - | ^ -Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 5129 | t5421 = t657*t1884*t59*t1975 + | ^ +Warning: 't1975' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:83: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3409:132: + 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & + | ^ +note: 't1975' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5528:70: - 3409 | *t234*t1737*t452) - | ^ -Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3453:132: + 5528 | + t5619 + t5622 - t5625 - t5628 + t5631 + t5716 + | ^ +Warning: 't1974' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:76: - 3453 | *t407) - | ^ -Warning: 't154' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3533:45: + 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & + | ^ +note: 't1974' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: - 3533 | - (5._dp*t1726*t506*t6*t407) - | ^ -Warning: 't153' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 5488 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't1973' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:69: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: + 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & + | ^ +note: 't1973' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5403:63: - 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) - | ^ -Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3364:21: + 5403 | t6106 = 0.3600000000e2_dp*t1971*t1972*t1973*t672 + | ^ +Warning: 't1972' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:62: - 3364 | *t58 - | ^ -Warning: 't146' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & + | ^ +note: 't1972' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5403:63: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't145' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3332:26: + 5403 | t6106 = 0.3600000000e2_dp*t1971*t1972*t1973*t672 + | ^ +Warning: 't1971' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:55: - 3332 | t1473 = t125*t141 - | ^ -Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3459:67: + 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & + | ^ +note: 't1971' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5393:57: - 3459 | - (16._dp*t752*t331)) - | ^ -Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3508:26: + 5393 | t6087 = 0.1666666667e0_dp*t429*t1966*t1410 + | ^ +Warning: 't1966' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:41: - 3508 | t2195 = t136*t137 - | ^ -Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & + | ^ +note: 't1966' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5077:68: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't134' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3314:59: + 5077 | *t462*t4729 + 0.3333333334e0_dp*t55*t57*t5276 + | ^ +Warning: 't1962' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:27: - 3314 | + 0.70e2_dp/0.9e1_dp*t695/t8/t1385*t56*t58 - | ^ -Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3232:46: + 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & + | ^ +note: 't1962' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3549:87: - 3232 | *t303*t1119 - t338*t303*t1136 - | ^ -Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3595:43: + 3549 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 + | ^ +Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:13: - 3595 | /0.4e1_dp*t603*t1469*t2473 - | ^ -Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3282:40: + 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & + | ^ +note: 't196' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3460:30: - 3282 | t1341 = 0.1e1_dp/t128/t115/t114 - | ^ -Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: + 3460 | t520 = t195*t25 + | ^ +Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3082:75: - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) - | ^ -Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3479:26: + 3082 | REAL(kind=dp) :: t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, t1958, & + | ^ +note: 't195' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4814:44: - 3479 | t2069 = t125*t126 - | ^ -Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3506:55: + 4814 | + (2*t147*t1284*t672) + | ^ +Warning: 't1940' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3082:55: - 3506 | *t585 - 0.27e2_dp/0.4e1_dp*t2069*t2155 + 3082 | REAL(kind=dp) :: t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, t1958, & | ^ -Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3328:35: - - 3328 | t1442 = 0.1e1_dp/t121/t114 - | ^ -Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2900:23: +note: 't1940' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3462:36: - 2900 | t309 = t12*rho - | ^ -Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3589:104: + 3462 | t527 = t194*t187*t526 + | ^ +Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3082:48: - 3589 | *t81*t1430*t2279) - (t81*t93*t595*t2279) - | ^ -Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3265:41: + 3082 | REAL(kind=dp) :: t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, t1958, & + | ^ +note: 't194' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: - 3265 | t1273 = 0.1e1_dp/t117/t1270/t114 + 4806 | *t1246*t3244*t1483 | ^ -Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2975:34: +Warning: 't1932' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3082:28: - 2975 | t447 = 0.1e1_dp/t117/t116 - | ^ -Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3499:33: + 3082 | REAL(kind=dp) :: t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, t1958, & + | ^ +note: 't1932' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5413:38: - 3499 | t2155 = t1341*t115*t2071 - | ^ -Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3485:32: + 5413 | t6138 = t429*t1928*t593 + | ^ +Warning: 't1928' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3081:62: - 3485 | t2090 = t480*t114*t2071 - | ^ -Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3481:32: + 3081 | t1914, t1917, t192, t1920, t1923, t1924, t1925, t1928 + | ^ +note: 't1928' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5414:38: - 3481 | t2072 = t480*t113*t2071 - | ^ -Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3613:82: + 5414 | t6141 = t658*t575*t1925 + | ^ +Warning: 't1925' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3081:55: - 3613 | *t238*t1139 + t289*t2336)*alpha8*t296) - | ^ -Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3483:26: + 3081 | t1914, t1917, t192, t1920, t1923, t1924, t1925, t1928 + | ^ +note: 't1925' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4823:58: - 3483 | t2084 = t110*t111 - | ^ -Warning: 't111' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: + 4823 | + 0.3333333334e0_dp*t165*t437*t1688 + | ^ +Warning: 't1924' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3081:48: - 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) - | ^ -Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3583:92: + 3081 | t1914, t1917, t192, t1920, t1923, t1924, t1925, t1928 + | ^ +note: 't1924' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5328:38: - 3583 | t2511) + 0.3e1_dp/0.2e1_dp*(t474)*(t481)*(t2515) - | ^ -Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3437:53: + 5328 | t5938 = t192*t728*t1505 + | ^ +Warning: 't192' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3081:27: - 3437 | 0.10e2_dp*t659*t234*t127*t452*(t407) - | ^ -Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3259:31: + 3081 | t1914, t1917, t192, t1920, t1923, t1924, t1925, t1928 + | ^ +note: 't192' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: - 3259 | t1261 = t136*t105*t108 - | ^ -Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3567:93: + 4695 | t1320*t1483 + | ^ +Warning: 't1912' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:95: - 3567 | t3*t19 + 12._dp*g3*t1*t24*t32) - | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: + 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & + | ^ +note: 't1912' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: - 3254 | /0.3e1_dp*t428*t972 + (20._dp*t100*t976)) - | ^ -Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:3254:59: Warning: 't100' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2940:24: + 4695 | t1320*t1483 + | ^ +Warning: 't1902' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:74: - 2940 | t375 = t374*t10 - | ^ -Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2943:24: + 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & + | ^ +note: 't1902' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: - 2943 | t382 = t1*ndrho - | ^ -Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 5488 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:60: - 2494 | *(t444) - | ^ -Warning: 't988' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: + 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & + | ^ +note: 't19' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5228:58: - 2479 | *t620*(t1240) - | ^ -Warning: 't982' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + 5228 | t5666 = 0.1125000000e2_dp*t1302*t1892*t1410 + | ^ +Warning: 't1892' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:41: - 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) - | ^ -Warning: 't972' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: Warning: 't971' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: Warning: 't965' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: + 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & + | ^ +note: 't1892' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3453:30: - 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) - | ^ -Warning: 't962' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: + 3453 | t503 = t189*t67 + | ^ +Warning: 't189' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:27: - 2514 | *t156*t444 + 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & | ^ -Warning: 't958' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: +note: 't189' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4814:44: - 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) - | ^ -Warning: 't954' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: Warning: 't951' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: Warning: 't945' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: Warning: 't942' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: + 4814 | + (2*t147*t1284*t672) + | ^ +Warning: 't1886' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:21: - 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 - | ^ -Warning: 't937' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: + 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & + | ^ +note: 't1886' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5481:36: - 2587 | t159 + (2._dp*t2267*t916) + (5._dp*t2267*t919) - | ^ -Warning: 't933' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2423:27: + 5481 | t5011 + t5001 + | ^ +Warning: 't1885' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:14: - 2423 | t2297 = t1305*t932 - | ^ -Warning: 't932' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: + 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & + | ^ +note: 't1885' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5129:43: - 2587 | t159 + (2._dp*t2267*t916) + (5._dp*t2267*t919) - | ^ -Warning: 't930' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: Warning: 't919' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2408:27: + 5129 | t5421 = t657*t1884*t59*t1975 + | ^ +Warning: 't1884' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3079:97: - 2408 | t2258 = t1547*t918 - | ^ -Warning: 't918' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: + 3079 | t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, t1884, & + | ^ +note: 't1884' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: - 2587 | t159 + (2._dp*t2267*t916) + (5._dp*t2267*t919) - | ^ -Warning: 't916' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 + | ^ +Warning: 't1875' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3079:76: - 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) - | ^ -Warning: 't910' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2482:26: + 3079 | t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, t1884, & + | ^ +note: 't1875' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3534:30: - 2482 | t2543 = t908*t620 - | ^ -Warning: 't908' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2436:26: + 3534 | t707 = t187*t59 + | ^ +Warning: 't187' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3079:55: - 2436 | t2348 = t176*t907 - | ^ -Warning: 't907' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: + 3079 | t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, t1884, & + | ^ +note: 't187' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5404:58: - 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) + 5404 | t6109 = 0.1666666667e0_dp*t1246*t1962*t1865 | ^ -Warning: 't904' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2404:26: +Warning: 't1865' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3079:42: - 2404 | t2245 = t902*t142 - | ^ -Warning: 't902' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: + 3079 | t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, t1884, & + | ^ +note: 't1865' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4807:32: - 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) - | ^ -Warning: 't898' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't897' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't893' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: + 4807 | t4498 = t56*t1843 + | ^ +Warning: 't1843' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:83: - 2403 | - t553*t77*t1236)/0.2e1_dp) - | ^ -Warning: 't892' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't891' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: + 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & + | ^ +note: 't1843' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5357:33: - 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) - | ^ -Warning: 't889' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2388:47: + 5357 | t6006 = t719*t1838 + | ^ +Warning: 't1838' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:69: - 2388 | + t1456*t340*t1457*t440) - | ^ -Warning: 't888' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: + 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & + | ^ +note: 't1838' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4719:70: - 2403 | - t553*t77*t1236)/0.2e1_dp) - | ^ -Warning: 't885' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't880' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: + 4719 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 + | ^ +Warning: 't1837' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:62: - 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) - | ^ -Warning: 't877' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: + 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & + | ^ +note: 't1837' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5314:42: - 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) - | ^ -Warning: 't876' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't874' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: + 5314 | t5908 = t1836*t59*t177*t710 + | ^ +Warning: 't1836' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:55: - 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) - | ^ -Warning: 't873' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: Warning: 't871' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2377:26: + 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & + | ^ +note: 't1836' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: - 2377 | t2142 = t870*t507 - | ^ -Warning: 't870' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: + 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 + | ^ +Warning: 't183' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:34: - 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) - | ^ -Warning: 't867' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't865' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: + 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & + | ^ +note: 't183' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5276:40: - 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) - | ^ -Warning: 't851' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: Warning: 't849' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: + 5276 | t5797 = t1373*t1962*t1829 + | ^ +Warning: 't1829' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:28: - 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) - | ^ -Warning: 't848' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2518:114: + 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & + | ^ +note: 't1829' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5122:57: - 2518 | *t68 - 2._dp*t842*t441 + 2._dp*t85*t1265 - t85*t1282) - | ^ -Warning: 't846' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: + 5122 | t5400 = 0.3333333334e0_dp*t445*t1962*t1825 + | ^ +Warning: 't1825' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:14: - 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) - | ^ -Warning: 't845' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: Warning: 't842' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2368:68: + 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & + | ^ +note: 't1825' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4747:29: - 2368 | t836 - t80*(t1663 + t1802 + t1898 + t2028)*Clda - | ^ -Warning: 't836' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: + 4747 | *t3382 + | ^ +Warning: 't1821' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:81: - 2304 | *t1649)*alpha6*t284*t286) - | ^ -Warning: 't832' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: Warning: 't826' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: Warning: 't823' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: Warning: 't820' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & + | ^ +note: 't1821' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: - 2494 | *(t444) - | ^ -Warning: 't817' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: + 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 + | ^ +Warning: 't182' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:74: - 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 - | ^ -Warning: 't816' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: + 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & + | ^ +note: 't182' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: - 2304 | *t1649)*alpha6*t284*t286) - | ^ -Warning: 't815' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 4737 | *t478*t183*t3918 + | ^ +Warning: 't1811' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:54: - 2494 | *(t444) - | ^ -Warning: 't812' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & + | ^ +note: 't1811' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5280:58: - 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 - | ^ -Warning: 't810' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: Warning: 't808' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: + 5280 | t5810 = 0.1080000000e3_dp*t1143*t1801*t1410 + | ^ +Warning: 't1801' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:26: - 2434 | *t84*t1579*t587*t444 - | ^ -Warning: 't804' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2226:93: + 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & + | ^ +note: 't1801' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5481:36: - 2226 | *t784) - (2._dp*t779*t656*t1297) - | ^ -Warning: 't803' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: + 5481 | t5011 + t5001 + | ^ +Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:12: - 2434 | *t84*t1579*t587*t444 - | ^ -Warning: 't801' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2226:93: + 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & + | ^ +note: 't18' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5332:52: - 2226 | *t784) - (2._dp*t779*t656*t1297) - | ^ -Warning: 't800' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2226:93: Warning: 't799' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2246:69: + 5332 | t5949 = 0.8999999998e1_dp*t1795*t4909 + | ^ +Warning: 't1795' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:90: - 2246 | /0.2e1_dp - t166*t1355*t83*t170 + (2._dp*t1294*t801) - | ^ -Warning: 't792' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: + 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & + | ^ +note: 't1795' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5340:34: - 2434 | *t84*t1579*t587*t444 - | ^ -Warning: 't791' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2246:69: + 5340 | t5966 = t1785*t1790 + | ^ +Warning: 't1790' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:76: - 2246 | /0.2e1_dp - t166*t1355*t83*t170 + (2._dp*t1294*t801) - | ^ -Warning: 't787' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: + 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & + | ^ +note: 't1790' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5340:34: - 2434 | *t84*t1579*t587*t444 - | ^ -Warning: 't784' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2246:69: + 5340 | t5966 = t1785*t1790 + | ^ +Warning: 't1785' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:55: - 2246 | /0.2e1_dp - t166*t1355*t83*t170 + (2._dp*t1294*t801) - | ^ -Warning: 't783' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2418:75: + 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & + | ^ +note: 't1785' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5387:51: - 2418 | t2269*t2271) - | ^ -Warning: 't781' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2246:69: + 5387 | t6078 = 0.1111111112e0_dp*t719*t1782 + | ^ +Warning: 't1782' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:41: - 2246 | /0.2e1_dp - t166*t1355*t83*t170 + (2._dp*t1294*t801) - | ^ -Warning: 't780' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2581:32: + 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & + | ^ +note: 't1782' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5356:38: - 2581 | *(t783)*(t2927) - | ^ -Warning: 't779' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 5356 | t6004 = t1709*t178*t710 + | ^ +Warning: 't178' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:34: - 2494 | *(t444) - | ^ -Warning: 't772' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2312:26: + 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & + | ^ +note: 't178' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5358:52: - 2312 | t1853 = t771*t275 - | ^ -Warning: 't771' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + 5358 | t6009 = 0.5000000001e0_dp*t1777*t4908 + | ^ +Warning: 't1777' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:21: - 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) - | ^ -Warning: 't769' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: + 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & + | ^ +note: 't1777' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5350:52: - 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 - | ^ -Warning: 't765' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: + 5350 | t5985 = 0.5000000001e0_dp*t1774*t4908 + | ^ +Warning: 't1774' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:96: - 2332 | *(t1176)) - t267*t1731)*alpha5*t271 - | ^ -Warning: 't763' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: + 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & + | ^ +note: 't1774' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3535:31: - 2304 | *t1649)*alpha6*t284*t286) - | ^ -Warning: 't761' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: Warning: 't759' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: + 3535 | t708 = t707*t177 + | ^ +Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:82: - 2351 | *(t746)*(t753)*(t1318) - | ^ -Warning: 't755' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2164:27: + 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & + | ^ +note: 't177' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5308:33: - 2164 | t1306 = t1305*t754 - | ^ -Warning: 't754' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2581:32: + 5308 | t5885 = t719*t1769 + | ^ +Warning: 't1769' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:76: - 2581 | *(t783)*(t2927) - | ^ -Warning: 't753' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: + 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & + | ^ +note: 't1769' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5382:40: - 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) - | ^ -Warning: 't752' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2450:65: + 5382 | t6060 = t1766*t5881*t4940 + | ^ +Warning: 't1766' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:62: - 2450 | *t2271 + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2311) - | ^ -Warning: 't748' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: + 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & + | ^ +note: 't1766' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5375:52: - 2351 | *(t746)*(t753)*(t1318) - | ^ -Warning: 't747' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: Warning: 't746' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: Warning: 't740' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2581:32: + 5375 | t6044 = 0.2000000002e1_dp*t1763*t5956 + | ^ +Warning: 't1763' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:48: - 2581 | *(t783)*(t2927) - | ^ -Warning: 't739' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2443:70: + 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & + | ^ +note: 't1763' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3722:30: - 2443 | t2363*t2305 + 0.5e1_dp/0.2e1_dp*(t735)*(t739)*(t2059) - | ^ -Warning: 't736' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2351:39: + 3722 | t1140 = t176**2 + | ^ +Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:27: - 2351 | *(t746)*(t753)*(t1318) - | ^ -Warning: 't735' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: + 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & + | ^ +note: 't176' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: - 2332 | *(t1176)) - t267*t1731)*alpha5*t271 - | ^ -Warning: 't728' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2481:26: + 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 + | ^ +Warning: 't1755' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3074:56: - 2481 | t2529 = t721*t444 - | ^ -Warning: 't721' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: + 3074 | t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757, t1758 + | ^ +note: 't1755' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5369:72: - 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) - | ^ -Warning: 't718' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: Warning: 't717' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: Warning: 't713' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: + 5369 | *t6021 + t6025 - 0.5555555558e-1_dp*t58*t5613*t71 + | ^ +Warning: 't1748' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3074:35: - 2332 | *(t1176)) - t267*t1731)*alpha5*t271 - | ^ -Warning: 't711' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2284:69: + 3074 | t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757, t1758 + | ^ +note: 't1748' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: - 2284 | - 0.3e1_dp/0.4e1_dp*t280*t1723 + t280*t1726/0.2e1_dp - | ^ -Warning: 't701' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2458:26: + 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + | ^ +Warning: 't1745' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3074:28: - 2458 | t2437 = t698*t444 - | ^ -Warning: 't698' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2284:69: + 3074 | t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757, t1758 + | ^ +note: 't1745' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5334:52: - 2284 | - 0.3e1_dp/0.4e1_dp*t280*t1723 + t280*t1726/0.2e1_dp - | ^ -Warning: 't697' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2284:69: Warning: 't691' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2352:35: + 5334 | t5954 = 0.8999999998e1_dp*t1741*t4909 + | ^ +Warning: 't1741' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3074:14: - 2352 | t1983 = 0.1e1_dp/t224/t690 - | ^ -Warning: 't690' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2270:26: + 3074 | t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757, t1758 + | ^ +note: 't1741' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5326:57: - 2270 | t1686 = t689*t257 - | ^ -Warning: 't689' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + 5326 | t5929 = 0.2250000000e2_dp*t1740*t471*t4905 + | ^ +Warning: 't1740' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:97: - 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 - | ^ -Warning: 't685' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & + | ^ +note: 't1740' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: - 2494 | *(t444) - | ^ -Warning: 't681' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 + | ^ +Warning: 't1737' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:90: - 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 - | ^ -Warning: 't679' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: Warning: 't673' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: + 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & + | ^ +note: 't1737' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4775:32: - 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) - | ^ -Warning: 't669' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 4775 | t4352 = t1731*t67 + | ^ +Warning: 't1731' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:76: - 2494 | *(t444) - | ^ -Warning: 't663' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: + 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & + | ^ +note: 't1731' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5360:52: - 2514 | *t156*t444 - | ^ -Warning: 't659' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: + 5360 | t6019 = 0.7407407410e-1_dp*t719*t1726 + | ^ +Warning: 't1726' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:55: - 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 - | ^ -Warning: 't658' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: + 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & + | ^ +note: 't1726' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5392:37: - 2304 | *t1649)*alpha6*t284*t286) - | ^ -Warning: 't657' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: + 5392 | *t6075 - t6078 + | ^ +Warning: 't1722' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:41: - 2514 | *t156*t444 - | ^ -Warning: 't656' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & + | ^ +note: 't1722' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5383:52: - 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 - | ^ -Warning: 't653' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: + 5383 | t6063 = 0.1000000000e1_dp*t1720*t5956 + | ^ +Warning: 't1720' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:34: - 2514 | *t156*t444 - | ^ -Warning: 't645' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2318:26: + 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & + | ^ +note: 't1720' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3554:70: - 2318 | t1885 = t644*t223 - | ^ -Warning: 't644' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + 3554 | *t165*t462*t561 + 0.3333333334e0_dp*t55*t57*t735 + | ^ +Warning: 't172' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:27: - 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) - | ^ -Warning: 't639' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2468:44: + 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & + | ^ +note: 't172' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5312:56: - 2468 | t2449 + t280*t2452/0.2e1_dp - | ^ -Warning: 't638' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: + 5312 | t5902 = 0.1800000000e2_dp*t1718*t178*t710 + | ^ +Warning: 't1718' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:14: - 2479 | *t620*(t1240) - | ^ -Warning: 't631' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: + 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & + | ^ +note: 't1718' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5339:34: - 2332 | *(t1176)) - t267*t1731)*alpha5*t271 - | ^ -Warning: 't629' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: + 5339 | t5964 = t1715*t1525 + | ^ +Warning: 't1715' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:89: - 2479 | *t620*(t1240) - | ^ -Warning: 't626' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: + 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & + | ^ +note: 't1715' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: - 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) - | ^ -Warning: 't624' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: + 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 + | ^ +Warning: 't1712' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:75: - 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 - | ^ -Warning: 't621' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2482:26: + 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & + | ^ +note: 't1712' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3479:26: - 2482 | t2543 = t908*t620 + 3479 | t537 | ^ -Warning: 't620' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: +Warning: 't171' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:68: - 2514 | *t156*t444 - | ^ -Warning: 't617' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: + 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & + | ^ +note: 't171' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5356:38: - 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) - | ^ -Warning: 't613' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: + 5356 | t6004 = t1709*t178*t710 + | ^ +Warning: 't1709' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:62: - 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) - | ^ -Warning: 't603' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2539:27: + 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & + | ^ +note: 't1709' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: - 2539 | t2841 = t602*t1285 - | ^ -Warning: 't602' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + 4859 | *t83*t45*t3581*t140 + | ^ +Warning: 't1706' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:48: - 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 + 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & | ^ -Warning: 't597' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2354:26: +note: 't1706' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4665:39: - 2354 | t1988 = t596*t199 - | ^ -Warning: 't596' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + 4665 | *t165*t3865*t237 + | ^ +Warning: 't1703' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:34: - 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 - | ^ -Warning: 't592' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: + 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & + | ^ +note: 't1703' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: - 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 + 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 | ^ -Warning: 't589' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: - - 2479 | *t620*(t1240) - | ^ -Warning: 't588' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: +Warning: 't1700' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:20: - 2494 | *(t444) - | ^ -Warning: 't587' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: + 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & + | ^ +note: 't1700' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5255:61: - 2479 | *t620*(t1240) - | ^ -Warning: 't583' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: + 5255 | t5738 = 0.4444444445e0_dp*t170*t114*t4782*t451 + | ^ +Warning: 't170' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:13: - 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) - | ^ -Warning: 't582' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2424:32: + 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & + | ^ +note: 't170' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3479:26: - 2424 | t2305 = t581*t168*t2072 - | ^ -Warning: 't581' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: + 3479 | t537 + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:96: - 2514 | *t156*t444 - | ^ -Warning: 't578' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: Warning: 't576' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2335:26: + 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & + | ^ +note: 't17' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: - 2335 | t1923 = t176*t575 - | ^ -Warning: 't575' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2407:50: + 4859 | *t83*t45*t3581*t140 + | ^ +Warning: 't1694' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:77: - 2407 | 0.7e1_dp/0.2e1_dp*t569*t571*t1240 - | ^ -Warning: 't572' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2407:50: Warning: 't571' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2407:50: Warning: 't569' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2201:26: + 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & + | ^ +note: 't1694' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: - 2201 | t1520 = t567*t142 - | ^ -Warning: 't567' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: + 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 + | ^ +Warning: 't1689' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:63: - 2403 | - t553*t77*t1236)/0.2e1_dp) - | ^ -Warning: 't563' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't562' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't558' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & + | ^ +note: 't1689' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5426:37: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ -Warning: 't557' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: + 5426 | t6175 = t83*t597*t1688 + | ^ +Warning: 't1688' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:56: - 2403 | - t553*t77*t1236)/0.2e1_dp) - | ^ -Warning: 't556' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't554' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: + 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & + | ^ +note: 't1688' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5191:33: - 2142 | *t1220 - t375*t340*t1237 - | ^ -Warning: 't553' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + 5191 | t5565 = t112*t1685 + | ^ +Warning: 't1685' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:49: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ -Warning: 't552' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't551' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't550' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't542' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't540' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't539' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2195:31: + 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & + | ^ +note: 't1685' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5175:43: - 2195 | t1478 = t125*t538*t129 - | ^ -Warning: 't538' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + 5175 | t5528 = t102*t327*t1684*t557 + | ^ +Warning: 't1684' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:42: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ -Warning: 't537' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2388:47: + 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & + | ^ +note: 't1684' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5164:38: - 2388 | + t1456*t340*t1457*t440) - | ^ -Warning: 't535' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + 5164 | t5496 = t366*t368*t1681 + | ^ +Warning: 't1681' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:35: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ -Warning: 't534' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't533' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't531' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2190:30: + 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & + | ^ +note: 't1681' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5169:38: - 2190 | t1442 = t96*t115*t525 - | ^ -Warning: 't525' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: + 5169 | t5511 = t1680*t3673*t23 + | ^ +Warning: 't1680' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:28: - 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) - | ^ -Warning: 't522' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: Warning: 't518' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2091:24: + 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & + | ^ +note: 't1680' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5163:49: - 2091 | t1086 = t4*t515 - | ^ -Warning: 't515' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: + 5163 | t5494 = 0.6400000000e2_dp*t7*t1677 + | ^ +Warning: 't1677' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:14: - 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 - | ^ -Warning: 't514' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: + 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & + | ^ +note: 't1677' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5165:44: - 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) - | ^ -Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: Warning: 't511' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: + 5165 | t5499 = 0.120e2_dp*t550*t1669 + | ^ +Warning: 't1669' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:82: - 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 - | ^ -Warning: 't510' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: + 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & + | ^ +note: 't1669' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5167:52: - 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) - | ^ -Warning: 't509' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: + 5167 | t5507 = 0.120e2_dp*t7*t640*t1667*t371 + | ^ +Warning: 't1667' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:75: - 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 - | ^ -Warning: 't508' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2377:26: + 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & + | ^ +note: 't1667' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3479:26: - 2377 | t2142 = t870*t507 + 3479 | t537 | ^ -Warning: 't507' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: +Warning: 't166' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:47: - 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 - | ^ -Warning: 't504' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: + 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & + | ^ +note: 't166' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5161:52: - 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) - | ^ -Warning: 't503' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: + 5161 | t5489 = 0.1600000000e2_dp*t1429*t1658 + | ^ +Warning: 't1658' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:41: - 2403 | - t553*t77*t1236)/0.2e1_dp) - | ^ -Warning: 't499' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & + | ^ +note: 't1658' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5160:54: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ -Warning: 't498' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2177:25: + 5160 | t5487 = 0.2160000000e3_dp*t7*t995*t1652 + | ^ +Warning: 't1652' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:20: - 2177 | t1379 = t495*t82 - | ^ -Warning: 't495' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: + 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & + | ^ +note: 't1652' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5271:57: - 2403 | - t553*t77*t1236)/0.2e1_dp) - | ^ -Warning: 't493' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't486' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't481' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: + 5271 | t5783 = 0.5555555557e-1_dp*t165*t5013*t433 + | ^ +Warning: 't165' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:13: - 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) - | ^ -Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2176:132: + 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & + | ^ +note: 't165' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4933:56: - 2176 | (F2*t1126*t68 - 2._dp*t475*t402 + 2._dp*t85*t1136 - t85*t1169)) - | ^ -Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: + 4933 | t102*t4838 - 0.20e1_dp*t102*t4850 + | ^ +Warning: 't1645' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:83: - 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) - | ^ -Warning: 't475' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: Warning: 't472' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: Warning: 't469' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2176:132: + 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & + | ^ +note: 't1645' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5158:49: - 2176 | (F2*t1126*t68 - 2._dp*t475*t402 + 2._dp*t85*t1136 - t85*t1169)) - | ^ -Warning: 't468' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 5158 | t5482 = 0.2160000000e3_dp*t7*t1642 + | ^ +Warning: 't1642' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:69: - 2494 | *(t444) - | ^ -Warning: 't465' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: + 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & + | ^ +note: 't1642' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: - 2304 | *t1649)*alpha6*t284*t286) - | ^ -Warning: 't463' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + | ^ +Warning: 't1640' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:62: - 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 - | ^ -Warning: 't457' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: + 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & + | ^ +note: 't1640' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3432:31: - 2514 | *t156*t444 - | ^ -Warning: 't454' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: Warning: 't453' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + 3432 | t445 = t164*t444 + | ^ +Warning: 't164' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:55: - 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 - | ^ -Warning: 't452' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: + 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & + | ^ +note: 't164' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5177:44: - 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 - | ^ -Warning: 't449' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2516:86: + 5177 | t5533 = 0.160e2_dp*t112*t1632 + | ^ +Warning: 't1632' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:28: - 2516 | + t2688)*Clda - | ^ -Warning: 't446' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2418:75: + 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & + | ^ +note: 't1632' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 2418 | t2269*t2271) - | ^ -Warning: 't444' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2155:34: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't1631' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:21: - 2155 | - t375*t340*t1282 - | ^ -Warning: 't442' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2518:114: + 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & + | ^ +note: 't1631' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5176:44: - 2518 | *t68 - 2._dp*t842*t441 + 2._dp*t85*t1265 - t85*t1282) - | ^ -Warning: 't441' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2388:47: + 5176 | t5531 = 0.160e2_dp*t112*t1626 + | ^ +Warning: 't1626' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:84: - 2388 | + t1456*t340*t1457*t440) - | ^ -Warning: 't440' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: + 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & + | ^ +note: 't1626' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: - 2135 | - (48._dp*t437*t398) - | ^ -Warning: 't437' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: 't432' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2155:34: + 4629 | *t321*t953*t1625 + | ^ +Warning: 't1625' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:77: - 2155 | - t375*t340*t1282 - | ^ -Warning: 't426' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: + 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & + | ^ +note: 't1625' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5179:44: - 2142 | *t1220 - t375*t340*t1237 - | ^ -Warning: 't425' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2389:26: + 5179 | t5537 = 0.160e2_dp*t112*t1622 + | ^ +Warning: 't1622' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:63: - 2389 | t2224 = t424*t377 - | ^ -Warning: 't424' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: + 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & + | ^ +note: 't1622' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: - 2129 | - 0.16e2_dp/0.3e1_dp*t420*t361*t364 - (16._dp*t421*t368) - | ^ -Warning: 't421' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: Warning: 't420' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: + 4629 | *t321*t953*t1625 + | ^ +Warning: 't1621' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:56: - 2151 | *a5*t21*t54*t65 - | ^ -Warning: 't419' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: + 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & + | ^ +note: 't1621' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5142:47: - 2129 | - 0.16e2_dp/0.3e1_dp*t420*t361*t364 - (16._dp*t421*t368) - | ^ -Warning: 't416' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: Warning: 't415' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: + 5142 | t5446 = 0.480e2_dp*t24*t23*t1618 + | ^ +Warning: 't1618' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:42: - 2142 | *t1220 - t375*t340*t1237 - | ^ -Warning: 't412' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2131:25: + 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & + | ^ +note: 't1618' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: - 2131 | t1214 = t411*t18 - | ^ -Warning: 't411' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: + 4629 | *t321*t953*t1625 + | ^ +Warning: 't1617' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:35: - 2514 | *t156*t444 - | ^ -Warning: 't409' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & + | ^ +note: 't1617' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: - 2494 | *(t444) - | ^ -Warning: 't406' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: + 4637 | *t339*t969 + | ^ +Warning: 't1616' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:28: - 2142 | *t1220 - t375*t340*t1237 - | ^ -Warning: 't403' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: + 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & + | ^ +note: 't1616' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5174:51: - 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) - | ^ -Warning: 't402' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + 5174 | t5525 = 0.2133333334e2_dp*t339*t1611 + | ^ +Warning: 't1611' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:62: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ -Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: + 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 + | ^ +note: 't1611' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4213:46: - 2135 | - (48._dp*t437*t398) - | ^ -Warning: 't398' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: 't392' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: + 4213 | - t1994 + t1997 - t2000 + | ^ +Warning: 't161' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:48: - 2118 | *t63) - | ^ -Warning: 't390' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: + 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 + | ^ +note: 't161' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5155:51: - 2135 | - (48._dp*t437*t398) - | ^ -Warning: 't386' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: + 5155 | t5474 = 0.4266666668e2_dp*t339*t1608 + | ^ +Warning: 't1608' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:42: - 2118 | *t63) - | ^ -Warning: 't385' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: + 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 + | ^ +note: 't1608' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5144:44: - 2135 | - (48._dp*t437*t398) - | ^ -Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: + 5144 | t5451 = 0.640e2_dp*t605*t1603 + | ^ +Warning: 't1603' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:21: - 2118 | *t63) - | ^ -Warning: 't378' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2389:26: + 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 + | ^ +note: 't1603' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: - 2389 | t2224 = t424*t377 - | ^ -Warning: 't377' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2110:34: + 4603 | *t3339 + | ^ +Warning: 't1602' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:14: - 2110 | t1134 = 0.1e1_dp/t376/t67 - | ^ -Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2120:32: + 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 + | ^ +note: 't1602' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3413:31: - 2120 | t1171 = t375*t340*t1169 - | ^ -Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: + 3413 | t394 = t393*t160 + | ^ +Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:88: - 2142 | *t1220 - t375*t340*t1237 - | ^ -Warning: 't373' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2096:36: + 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & + | ^ +note: 't160' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3852:46: - 2096 | t1097 = 4._dp*t11*t348*t372 - | ^ -Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2199:26: + 3852 | t1439 = 0.1e1_dp/t787/t16*t1438 + | ^ +Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:82: - 2199 | t1498 = t371*t377 - | ^ -Warning: 't371' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: + 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & + | ^ +note: 't16' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5185:49: - 2135 | - (48._dp*t437*t398) - | ^ -Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: Warning: 't364' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2100:26: + 5185 | t5551 = 0.1280e3_dp*t24*t298*t1599 + | ^ +Warning: 't1599' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:77: - 2100 | t1115 = t363*t312 - | ^ -Warning: 't363' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: + 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & + | ^ +note: 't1599' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 2106 | *t25*t1123) - | ^ -Warning: 't362' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2135:37: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't1598' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:70: - 2135 | - (48._dp*t437*t398) - | ^ -Warning: 't361' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: + 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & + | ^ +note: 't1598' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: - 2129 | - 0.16e2_dp/0.3e1_dp*t420*t361*t364 - (16._dp*t421*t368) - | ^ -Warning: 't358' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: + 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't1597' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:63: - 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) - | ^ -Warning: 't357' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2129:73: + 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & + | ^ +note: 't1597' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5188:52: - 2129 | - 0.16e2_dp/0.3e1_dp*t420*t361*t364 - (16._dp*t421*t368) - | ^ -Warning: 't354' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: + 5188 | t5560 = 0.2346666666e3_dp*t1589*t1592 + | ^ +Warning: 't1592' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:42: - 2106 | *t25*t1123) - | ^ -Warning: 't353' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & + | ^ +note: 't1592' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ -Warning: 't352' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: + 4637 | *t339*t969 + | ^ +Warning: 't1589' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:28: - 2142 | *t1220 - t375*t340*t1237 - | ^ -Warning: 't349' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & + | ^ +note: 't1589' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5146:46: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ -Warning: 't348' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: + 5146 | t5456 = 0.1280e3_dp*t1582*t1426 + | ^ +Warning: 't1582' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:84: - 2118 | *t63) - | ^ -Warning: 't346' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: + 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & + | ^ +note: 't1582' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: - 2142 | *t1220 - t375*t340*t1237 - | ^ -Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2113:38: + 4859 | *t83*t45*t3581*t140 + | ^ +Warning: 't1575' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:56: - 2113 | t1139 = 2._dp*t375*t340*t1136 - | ^ -Warning: 't340' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2142:41: + 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & + | ^ +note: 't1575' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5424:56: - 2142 | *t1220 - t375*t340*t1237 - | ^ -Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2125:26: + 5424 | t6170 = 0.3333333336e0_dp*t289*t597*t1571 + | ^ +Warning: 't1571' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:42: - 2125 | t1178 = t411*t338 - | ^ -Warning: 't338' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2516:86: + 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & + | ^ +note: 't1571' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4665:39: - 2516 | + t2688)*Clda - | ^ -Warning: 't1069' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 4665 | *t165*t3865*t237 + | ^ +Warning: 't1568' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:28: - 2494 | *(t444) - | ^ -Warning: 't1066' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: + 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & + | ^ +note: 't1568' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4665:39: - 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 - | ^ -Warning: 't1052' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: Warning: 't1035' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 4665 | *t165*t3865*t237 + | ^ +Warning: 't1565' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:21: - 2494 | *(t444) - | ^ -Warning: 't1024' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: + 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & + | ^ +note: 't1565' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5428:38: - 2479 | *t620*(t1240) - | ^ -Warning: 't1009' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: Warning: 't1001' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2450:65: + 5428 | t6181 = t289*t1564*t593 + | ^ +Warning: 't1564' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:14: - 2450 | *t2271 + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2311) + 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & + | ^ +note: 't1564' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4405:65: + + 4405 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 | ^ -Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: +Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:82: - 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) - | ^ -Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: + 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & + | ^ +note: 't156' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5438:56: - 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) - | ^ -Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + 5438 | t6201 = 0.3333333336e0_dp*t289*t597*t1557 + | ^ +Warning: 't1557' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:76: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ -Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & + | ^ +note: 't1557' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5429:56: - 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 - | ^ -Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2340:30: + 5429 | t6185 = 0.3333333336e0_dp*t289*t597*t1553 + | ^ +Warning: 't1553' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:62: - 2340 | t1961 = t180*t90*t149 - | ^ -Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & + | ^ +note: 't1553' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4393:39: - 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 - | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2006:41: + 4393 | *t400*t401*t2230 + | ^ +Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:48: - 2006 | t848 = 2._dp*t412*t88 + t11*t846 - | ^ -Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2176:132: + 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & + | ^ +note: 't155' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: - 2176 | (F2*t1126*t68 - 2._dp*t475*t402 + 2._dp*t85*t1136 - t85*t1169)) - | ^ -Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2518:114: + 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 + | ^ +Warning: 't1547' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:35: - 2518 | *t68 - 2._dp*t842*t441 + 2._dp*t85*t1265 - t85*t1282) - | ^ -Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2434:37: + 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & + | ^ +note: 't1547' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: - 2434 | *t84*t1579*t587*t444 - | ^ -Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2587:63: + 4851 | *t289*t294*t1553 + | ^ +Warning: 't1546' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:28: - 2587 | t159 + (2._dp*t2267*t916) + (5._dp*t2267*t919) - | ^ -Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1836:24: + 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & + | ^ +note: 't1546' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: - 1836 | t486 = t82*t453 - | ^ -Warning: 't82' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2612:65: + 4870 | t3869 + t4657 + t4696) + | ^ +Warning: 't1536' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:84: - 2612 | e_ndrho_ndrho = e_ndrho_ndrho - t80*(t2963 + t3167)*Clda - | ^ -Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: + 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & + | ^ +note: 't1536' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4936:42: - 2304 | *t1649)*alpha6*t284*t286) - | ^ -Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2157:23: + 4936 | t4864 = t217*t46*t1535*t561 + | ^ +Warning: 't1535' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:77: - 2157 | t1287 = t78**2 - | ^ -Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2459:30: + 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & + | ^ +note: 't1535' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: - 2459 | t2442 = t75*t409*t444 - | ^ -Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2123:71: + 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 + | ^ +Warning: 't1531' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:70: - 2123 | - t1132 + t1139 - t1171 + 0.10e2_dp/0.9e1_dp*t73*t1173 - | ^ -Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & + | ^ +note: 't1531' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4964:52: - 2494 | *(t444) - | ^ -Warning: 't72' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1817:53: + 4964 | t4932 = 0.5000000001e0_dp*t1528*t4908 + | ^ +Warning: 't1528' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:56: - 1817 | t444 = 2._dp*t412*t70 + t11*t426 - t375*t442 - | ^ -Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2095:36: + 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & + | ^ +note: 't1528' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4972:33: - 2095 | t1094 = 6._dp*t11*t1091*t69 - | ^ -Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2016:25: + 4972 | t4952 = t719*t1525 + | ^ +Warning: 't1525' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:49: - 2016 | t876 = t68*ndrho - | ^ -Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1781:22: + 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & + | ^ +note: 't1525' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5384:42: - 1781 | t376 = t67**2 - | ^ -Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: + 5384 | t6066 = t1519*t705*t561*t65 + | ^ +Warning: 't1519' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:35: - 2151 | *a5*t21*t54*t65 - | ^ -Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: + 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & + | ^ +note: 't1519' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5361:39: - 2118 | *t63) - | ^ -Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1790:31: + 5361 | t6021 = t649*t1518*t1722 + | ^ +Warning: 't1518' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:28: - 1790 | t398 = t60/t61/rho*t63 - | ^ -Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: + 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & + | ^ +note: 't1518' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4962:52: - 2118 | *t63) - | ^ -Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: + 4962 | t4925 = 0.5000000001e0_dp*t1513*t4908 + | ^ +Warning: 't1513' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:94: - 2151 | *a5*t21*t54*t65 - | ^ -Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: + 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & + | ^ +note: 't1513' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: - 2118 | *t63) - | ^ -Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2101:27: + 4755 | t192*t68*t4256*t65 + | ^ +Warning: 't1510' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:80: - 2101 | t1119 = t46*t31*t6 - | ^ -Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & + | ^ +note: 't1510' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4167:80: - 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 - | ^ -Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: + 4167 | + t1482 + t1479 - t1489 + 0.3333333334e0_dp*t55*t57*t2042 + | ^ +Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:73: - 2118 | *t63) - | ^ -Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2182:33: + 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & + | ^ +note: 't151' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4956:52: - 2182 | t1409 = t116*t377*t4*t44 - | ^ -Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: + 4956 | t4911 = 0.8999999998e1_dp*t1507*t4909 + | ^ +Warning: 't1507' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:60: - 2118 | *t63) - | ^ -Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1813:26: + 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & + | ^ +note: 't1507' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4953:57: - 1813 | t437 = a5*t38*t54 - | ^ -Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: + 4953 | t4907 = 0.2250000000e2_dp*t1506*t471*t4905 + | ^ +Warning: 't1506' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:53: - 2118 | *t63) - | ^ -Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2118:47: Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2200:26: + 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & + | ^ +note: 't1506' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5328:38: - 2200 | t1501 = t34*t1134 - | ^ -Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2368:68: + 5328 | t5938 = t192*t728*t1505 + | ^ +Warning: 't1505' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:46: - 2368 | t836 - t80*(t1663 + t1802 + t1898 + t2028)*Clda - | ^ -Warning: 't336' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & + | ^ +note: 't1505' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5378:37: - 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) - | ^ -Warning: 't333' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2332:58: + 5378 | t6052 = t1504*t561*t65 + | ^ +Warning: 't1504' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:39: - 2332 | *(t1176)) - t267*t1731)*alpha5*t271 - | ^ -Warning: 't332' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & + | ^ +note: 't1504' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4946:39: - 2494 | *(t444) - | ^ -Warning: 't330' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1824:25: + 4946 | t4895 = t478*t1500*t4729 + | ^ +Warning: 't1500' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:25: - 1824 | t457 = t329*t330 + 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & | ^ -Warning: 't329' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: +note: 't1500' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: - 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) - | ^ -Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: + 4516 | + t3288) + | ^ +Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:18: - 2151 | *a5*t21*t54*t65 - | ^ -Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: + 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & + | ^ +note: 't150' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4943:57: - 2304 | *t1649)*alpha6*t284*t286) - | ^ -Warning: 't319' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + 4943 | t4887 = 0.1800000000e2_dp*t473*t1493*t4729 + | ^ +Warning: 't1493' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3061:83: - 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) - | ^ -Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + 3061 | REAL(kind=dp) :: t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, t1498, & + | ^ +note: 't1493' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3342:31: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ -Warning: 't315' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2456:71: + 3342 | t250 = t149*t249 + | ^ +Warning: 't149' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3061:69: - 2456 | *t765 - t937*t626/0.3e1_dp + (t2371 + t2401)*t185*t190 - | ^ -Warning: 't311' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1963:25: + 3061 | REAL(kind=dp) :: t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, t1498, & + | ^ +note: 't149' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5405:59: - 1963 | t761 = t310*t311 - | ^ -Warning: 't310' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2102:29: + 5405 | t6112 = 0.5555555556e-1_dp*t1246*t4553*t1483 + | ^ +Warning: 't1483' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3061:49: - 2102 | t1123 = t27*t390*t31 - | ^ -Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2272:38: + 3061 | REAL(kind=dp) :: t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, t1498, & + | ^ +note: 't1483' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: - 2272 | t1697 = f2732/t295/t1693/t250 + 5005 | + t5032 + t5035 | ^ -Warning: 't295' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2253:25: - - 2253 | t1633 = f94/t294 - | ^ -Warning: 't294' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: +Warning: 't1471' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:74: - 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) - | ^ -Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2267:41: + 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 + | ^ +note: 't1471' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4555:38: - 2267 | t1680 = 0.1e1_dp/t290/t1677/t690 - | ^ -Warning: 't290' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: + 4555 | t165*t171*t3449 + | ^ +Warning: 't1470' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:67: - 2304 | *t1649)*alpha6*t284*t286) - | ^ -Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1934:34: + 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 + | ^ +note: 't1470' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: - 1934 | t689 = 0.1e1_dp/t290/t289 - | ^ -Warning: 't289' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: + 5005 | + t5032 + t5035 + | ^ +Warning: 't1466' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:54: - 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) - | ^ -Warning: 't286' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: + 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 + | ^ +note: 't1466' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: - 2304 | *t1649)*alpha6*t284*t286) - | ^ -Warning: 't285' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: + 5005 | + t5032 + t5035 + | ^ +Warning: 't1459' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:41: - 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) - | ^ -Warning: 't284' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2289:32: + 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 + | ^ +note: 't1459' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5558:32: - 2289 | t1770 = t1767*t1768*t28 + 5558 | t6557 = t1447*t59 | ^ -Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: +Warning: 't1447' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:14: - 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) - | ^ -Warning: 't276' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 + | ^ +note: 't1447' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5178:45: - 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) - | ^ -Warning: 't275' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2311:25: + 5178 | t5535 = 0.640e2_dp*t1582*t1444 + | ^ +Warning: 't1444' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:97: - 2311 | t1846 = t75*t273 - | ^ -Warning: 't273' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: + 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & + | ^ +note: 't1444' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5197:53: - 2514 | *t156*t444 - | ^ -Warning: 't271' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1988:25: + 5197 | t5579 = 0.80e1_dp*t102*t327*t645*t1443 + | ^ +Warning: 't1443' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:90: - 1988 | t815 = t270*t193 - | ^ -Warning: 't270' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: + 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & + | ^ +note: 't1443' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4927:59: - 2403 | - t553*t77*t1236)/0.2e1_dp) - | ^ -Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2316:41: + 4927 | - 0.2400000000e2_dp*t786/t2492*t1058 + | ^ +Warning: 't1440' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:83: - 2316 | t1880 = 0.1e1_dp/t258/t1677/t222 - | ^ -Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2468:44: + 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & + | ^ +note: 't1440' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: - 2468 | t2449 + t280*t2452/0.2e1_dp - | ^ -Warning: 't257' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: + 4851 | *t289*t294*t1553 + | ^ +Warning: 't144' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:76: - 2514 | *t156*t444 - | ^ -Warning: 't256' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2273:40: + 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & + | ^ +note: 't144' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4614:34: - 2273 | t1709 = 0.1e1_dp/t252/t293/t250 - | ^ -Warning: 't252' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2284:69: + 4614 | t3679 = t2565*t1439 + | ^ +Warning: 't1439' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:70: - 2284 | - 0.3e1_dp/0.4e1_dp*t280*t1723 + t280*t1726/0.2e1_dp - | ^ -Warning: 't251' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & + | ^ +note: 't1439' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: - 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) - | ^ -Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: + 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + | ^ +Warning: 't1438' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:63: - 2106 | *t25*t1123) - | ^ -Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: + 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & + | ^ +note: 't1438' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: - 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) - | ^ -Warning: 't247' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1909:25: + 4622 | *t786*t1034*t1681 + | ^ +Warning: 't1429' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:49: - 1909 | t629 = t246*t192 - | ^ -Warning: 't246' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & + | ^ +note: 't1429' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5146:46: - 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) - | ^ -Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: Warning: 't239' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2304:94: + 5146 | t5456 = 0.1280e3_dp*t1582*t1426 + | ^ +Warning: 't1426' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:42: - 2304 | *t1649)*alpha6*t284*t286) - | ^ -Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2276:35: + 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & + | ^ +note: 't1426' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5156:55: - 2276 | t1722 = 0.1e1_dp/t227/t250 - | ^ -Warning: 't227' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2352:35: + 5156 | t5478 = 0.240e2_dp*t1616*t973*t645*t1425 + | ^ +Warning: 't1425' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:35: - 2352 | t1983 = 0.1e1_dp/t224/t690 + 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & | ^ -Warning: 't224' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: +note: 't1425' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5151:51: - 2514 | *t156*t444 - | ^ -Warning: 't223' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1935:25: + 5151 | t5468 = 0.2346666666e3_dp*t605*t1420 + | ^ +Warning: 't1420' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:28: - 1935 | t690 = t256*t222 - | ^ -Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: + 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & + | ^ +note: 't1420' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: - 2106 | *t25*t1123) - | ^ -Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1896:24: + 4870 | t3869 + t4657 + t4696) + | ^ +Warning: 't1411' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:94: - 1896 | t592 = t219*t72 - | ^ -Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & + | ^ +note: 't1411' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5416:58: - 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) - | ^ -Warning: 't214' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1907:26: + 5416 | t6155 = 0.2500000000e0_dp*t1981*t4032*t1410 + | ^ +Warning: 't1410' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:87: - 1907 | t624 = t213*omega - | ^ -Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2151:32: + 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & + | ^ +note: 't1410' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3485:108: - 2151 | *a5*t21*t54*t65 - | ^ -Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1930:29: + 3485 | t46*t541))*sx + | ^ +Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:80: - 1930 | t673 = t97/t205/t199 - | ^ -Warning: 't205' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & + | ^ +note: 't141' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: - 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) - | ^ -Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: + 4870 | t3869 + t4657 + t4696) + | ^ +Warning: 't1409' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:74: - 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) - | ^ -Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & + | ^ +note: 't1409' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3554:70: - 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 - | ^ -Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 3554 | *t165*t462*t561 + 0.3333333334e0_dp*t55*t57*t735 + | ^ +Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:46: - 2494 | *(t444) - | ^ -Warning: 't193' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: + 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & + | ^ +note: 't140' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: - 2479 | *t620*(t1240) - | ^ -Warning: 't192' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: + 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + | ^ +Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:40: - 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) - | ^ -Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: + 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & + | ^ +note: 't14' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5213:57: - 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) - | ^ -Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2265:101: + 5213 | t5622 = 0.1666666667e0_dp*t165*t1392*t4729 + | ^ +Warning: 't1392' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:21: - 2265 | *t1301) - (15._dp*t1658*t271*t588*t453) - | ^ -Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: + 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & + | ^ +note: 't1392' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4814:44: - 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) - | ^ -Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2162:26: + 4814 | + (2*t147*t1284*t672) + | ^ +Warning: 't1388' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:14: - 2162 | t1304 = t166*t181 - | ^ -Warning: 't181' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: + 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & + | ^ +note: 't1388' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: - 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) - | ^ -Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2437:26: + 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 + | ^ +Warning: 't1387' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:96: - 2437 | t2363 = t176*t177 - | ^ -Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2366:48: + 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & + | ^ +note: 't1387' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: - 2366 | /0.9e1_dp*t457/t9/t1770*t56*t58 - | ^ -Warning: 't174' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: + 4806 | *t1246*t3244*t1483 + | ^ +Warning: 't1377' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:89: - 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) - | ^ -Warning: 't170' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: + 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & + | ^ +note: 't1377' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5138:39: - 2106 | *t25*t1123) - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2170:40: + 5138 | t5432 = t1373*t446*t5430 + | ^ +Warning: 't1373' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:82: - 2170 | t1324 = 0.1e1_dp/t169/t156/t155 - | ^ -Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2494:24: + 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & + | ^ +note: 't1373' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: - 2494 | *(t444) - | ^ -Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2410:26: + 5031 | *t105*t5118 + | ^ +Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:68: - 2410 | t2269 = t166*t167 - | ^ -Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2418:75: + 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & + | ^ +note: 't137' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4555:38: - 2418 | t2269*t2271) - | ^ -Warning: 't163' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2239:35: + 4555 | t165*t171*t3449 + | ^ +Warning: 't1368' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:62: - 2239 | t1579 = 0.1e1_dp/t162/t155 - | ^ -Warning: 't162' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: + 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & + | ^ +note: 't1368' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4823:58: - 2106 | *t25*t1123) - | ^ -Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2479:30: + 4823 | + 0.3333333334e0_dp*t165*t437*t1688 + | ^ +Warning: 't1360' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:48: - 2479 | *t620*(t1240) - | ^ -Warning: 't159' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2233:41: + 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & + | ^ +note: 't1360' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3378:31: - 2233 | t1562 = 0.1e1_dp/t158/t1559/t155 + 3378 | t328 = t136*t233 + | ^ +Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:41: + + 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & | ^ -Warning: 't158' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1890:34: +note: 't136' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4798:66: - 1890 | t581 = 0.1e1_dp/t158/t157 - | ^ -Warning: 't157' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2514:27: + 4798 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 + | ^ +Warning: 't1348' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:35: - 2514 | *t156*t444 - | ^ -Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2422:32: + 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & + | ^ +note: 't1348' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4682:40: - 2422 | t2291 = t752*t155*t2072 - | ^ -Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2411:32: + 4682 | *t400*t1333*t1410 + | ^ +Warning: 't1340' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:21: - 2411 | t2271 = t752*t154*t2072 - | ^ -Warning: 't154' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2570:55: + 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & + | ^ +note: 't1340' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5220:57: - 2570 | + (5._dp*t2329*t965) - (t81*t93*t1285) - | ^ -Warning: 't153' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2419:26: + 5220 | t5641 = 0.1500000000e1_dp*t405*t1333*t4729 + | ^ +Warning: 't1333' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:14: - 2419 | t2280 = t151*t152 - | ^ -Warning: 't152' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & + | ^ +note: 't1333' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ -Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2597:92: + 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 + | ^ +Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:92: - 2597 | t2975) + 0.3e1_dp/0.2e1_dp*(t746)*(t753)*(t2979) + 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & | ^ -Warning: 't149' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2309:32: - - 2309 | t1835 = t148*t149*t1562 - | ^ -Warning: 't148' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2336:31: +note: 't133' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: - 2336 | t1932 = t176*t147*t149 - | ^ -Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: + 4695 | t1320*t1483 + | ^ +Warning: 't1320' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:86: - 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) - | ^ -Warning: 't145' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1883:25: + 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & + | ^ +note: 't1320' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: - 1883 | t569 = t141*t142 - | ^ -Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2375:93: + 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 + | ^ +Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:79: - 2375 | t441 - t842*t402 + 2._dp*t85*t1220 - t85*t1237) - | ^ -Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: + 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & + | ^ +note: 't132' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: - 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) - | ^ -Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: + 4695 | t1320*t1483 + | ^ +Warning: 't1316' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:73: - 2403 | - t553*t77*t1236)/0.2e1_dp) - | ^ -Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & + | ^ +note: 't1316' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4308:43: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ + 4308 | t2565 = t126/t131/t1056/t130 + | ^ Warning: 't131' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2403:131: - - 2403 | - t553*t77*t1236)/0.2e1_dp) - | ^ -Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2611:106: - - 2611 | alpha6*t284*t286) - (12._dp*t1740*t194*t44*t2715) - | ^ -Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:66: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ -Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1870:30: + 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & + | ^ +note: 't131' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5231:57: - 1870 | t550 = t125*t126*t128 - | ^ -Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2191:25: + 5231 | t5670 = 0.2250000000e1_dp*t400*t1309*t4729 + | ^ +Warning: 't1309' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:60: - 2191 | t1445 = t96*t124 - | ^ -Warning: 't124' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: + 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & + | ^ +note: 't1309' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5235:57: - 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) - | ^ -Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2385:123: + 5235 | t5679 = 0.1875000000e1_dp*t1302*t406*t5002 + | ^ +Warning: 't1302' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:53: - 2385 | *t871*t522) + (2._dp*t508*t357*t873) - (4._dp*t877*t522) - | ^ -Warning: 't120' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1760:23: + 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & + | ^ +note: 't1302' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4672:33: - 1760 | t346 = t12*rho - | ^ -Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2388:47: + 4672 | t3939 = t1301*t245 + | ^ +Warning: 't1301' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:46: - 2388 | + t1456*t340*t1457*t440) - | ^ -Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2188:68: + 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & + | ^ +note: 't1301' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: - 2188 | *t514*t1078*t14*t517 + 0.6e1_dp*t118*t119*t1091*t77 - | ^ -Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: + 5488 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't1300' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:39: - 2536 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1285) - | ^ -Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2536:58: Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1840:30: + 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & + | ^ +note: 't1300' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4308:43: - 1840 | t498 = t109/t110/t495 - | ^ -Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2176:132: + 4308 | t2565 = t126/t131/t1056/t130 + | ^ +Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:32: - 2176 | (F2*t1126*t68 - 2._dp*t475*t402 + 2._dp*t85*t1136 - t85*t1169)) - | ^ -Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2219:58: + 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & + | ^ +note: 't130' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3580:44: - 2219 | - 0.7e1_dp/0.2e1_dp*(t569)*(t571)*(t1301) - | ^ -Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:2106:88: + 3580 | t796 = 0.1e1_dp/t787/t13*t795 + | ^ +Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:26: - 2106 | *t25*t1123) - | ^ -Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F:1803:24: + 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & + | ^ +note: 't13' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5136:57: - 1803 | t419 = t1*ndrho - | ^ -Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xwpbe.mod' due to: xc_xwpbe.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xwpbe.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathlib.mod mathconstants.mod base_hooks.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xpbe_hole_t_c_lr.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathlib.mod mathconstants.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F xc_xpbe_hole_t_c_lr.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:07:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xpbe_hole_t_c_lr.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xpbe_hole_t_c_lr.F90 -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 5136 | t5429 = 0.1666666667e0_dp*t445*t1292*t5143 + | ^ +Warning: 't1292' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:21: - 1058 | Clda)*sx - | ^ -Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & + | ^ +note: 't1292' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4814:44: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1070:24: + 4814 | + (2*t147*t1284*t672) + | ^ +Warning: 't1284' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:96: - 1070 | t586 = t86*t225 - | ^ -Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1020:32: + 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & + | ^ +note: 't1284' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4791:39: - 1020 | t352 = 0.1e1_dp/t85/t33 - | ^ -Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 4791 | *t429*t1928*t290 + | ^ +Warning: 't1283' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:89: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & + | ^ +note: 't1283' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4833:71: - 1058 | Clda)*sx - | ^ -Warning: 't81' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1031:23: + 4833 | *t3507 - t3512)*t149*t160 + | ^ +Warning: 't1275' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:82: - 1031 | t415 = t79*t21 - | ^ -Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1066:38: + 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & + | ^ +note: 't1275' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4798:66: - 1066 | t531 = F1*t235*t34 - t77*t529 - | ^ -Warning: 't77' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 4798 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 + | ^ +Warning: 't1264' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:68: - 1058 | Clda)*sx - | ^ -Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1034:23: + 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & + | ^ +note: 't1264' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: - 1034 | t461 = t74*t21 - | ^ -Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 + | ^ +Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:61: - 1058 | Clda)*sx - | ^ -Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & + | ^ +note: 't126' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5269:59: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 5269 | t5776 = 0.2777777778e-1_dp*t1246*t1247*t5009 + | ^ +Warning: 't1247' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:48: - 1058 | Clda)*sx - | ^ -Warning: 't64' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't58' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1008:22: + 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & + | ^ +note: 't1247' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5269:59: - 1008 | t305 = t56**2 - | ^ -Warning: 't56' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 5269 | t5776 = 0.2777777778e-1_dp*t1246*t1247*t5009 + | ^ +Warning: 't1246' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:41: - 1058 | Clda)*sx - | ^ -Warning: 't52' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1007:28: + 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & + | ^ +note: 't1246' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: - 1007 | t299 = 0.1e1_dp/t51 - | ^ -Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:978:47: + 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + | ^ +Warning: 't1235' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:20: - 978 | t211 = 0.2e1_dp/0.3e1_dp*t50*t93*t7*t4 - | ^ -Warning: 't50' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & + | ^ +note: 't1235' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 + | ^ +Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:13: - 1058 | Clda)*sx - | ^ -Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & + | ^ +note: 't123' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:996:27: + 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + | ^ +Warning: 't1224' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:95: - 996 | *t37*t248 - | ^ -Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & + | ^ +note: 't1224' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: - 1058 | Clda)*sx - | ^ -Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 + | ^ +Warning: 't1221' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:88: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1002:45: + 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & + | ^ +note: 't1221' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3391:81: - 1002 | t280 = 0.1e1_dp/t21*t33*t276*t1*t278 - | ^ -Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:976:59: + 3391 | t360 = 0.28e2_dp/0.3e1_dp*t122*t114 - 0.28e2_dp/0.3e1_dp*t356*t357 + | ^ +Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:81: - 976 | t204 = 4*t193*t185 + 5*t196*t197 + 6*t200*t31*t174 - | ^ -Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:991:24: + 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & + | ^ +note: 't122' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: - 991 | t242 = t27*t225 - | ^ -Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1028:23: + 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 + | ^ +Warning: 't1216' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:75: - 1028 | t406 = t25*t31 - | ^ -Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:985:54: + 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & + | ^ +note: 't1216' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: - 985 | *t41 - 0.9e1_dp/0.4e1_dp*t22*t221*t204 - | ^ -Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1034:23: + 4755 | t192*t68*t4256*t65 + | ^ +Warning: 't1213' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:68: - 1034 | t461 = t74*t21 - | ^ -Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:988:24: + 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & + | ^ +note: 't1213' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: - 988 | t232 = t19*t225 - | ^ -Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1014:22: + 4726 | *t58*t3796*t71 + | ^ +Warning: 't1207' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:54: - 1014 | t330 = g4*t17 - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & + | ^ +note: 't1207' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: - 1058 | Clda)*sx - | ^ -Warning: 't158' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 + | ^ +Warning: 't1201' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:40: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & + | ^ +note: 't1201' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: - 1058 | Clda)*sx - | ^ -Warning: 't152' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1009:34: + 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + | ^ +Warning: 't1200' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:33: - 1009 | t307 = 0.1e1_dp/t305*t150 - | ^ -Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & + | ^ +note: 't1200' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4575:35: - 1058 | Clda)*sx - | ^ -Warning: 't146' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't143' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 4575 | t3546 = 0.1e1_dp/t12 + | ^ +Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:26: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't142' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & + | ^ +note: 't12' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: - 1058 | Clda)*sx - | ^ -Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + | ^ +Warning: 't1194' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:76: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 + | ^ +note: 't1194' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4712:66: - 1058 | Clda)*sx - | ^ -Warning: 't138' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 4712 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 + | ^ +Warning: 't1193' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:69: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't135' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 + | ^ +note: 't1193' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: - 1058 | Clda)*sx - | ^ -Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + | ^ +Warning: 't1192' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:62: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:987:24: + 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 + | ^ +note: 't1192' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: - 987 | t229 = t13*t225 - | ^ -Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 4613 | + 0.3200000000e2_dp*t1055*t3674 + | ^ +Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:48: - 1058 | Clda)*sx - | ^ -Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:999:28: + 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 + | ^ +note: 't119' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: - 999 | t272 = t268/t12/t13 - | ^ -Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + | ^ +Warning: 't1189' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:42: - 1058 | Clda)*sx - | ^ -Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 + | ^ +note: 't1189' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4747:29: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 4747 | *t3382 + | ^ +Warning: 't1176' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:35: - 1058 | Clda)*sx - | ^ -Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 + | ^ +note: 't1176' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:965:23: + 4806 | *t1246*t3244*t1483 + | ^ +Warning: 't1172' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:28: - 965 | t183 = t12*t11 - | ^ -Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1058:34: + 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 + | ^ +note: 't1172' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: - 1058 | Clda)*sx - | ^ -Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:1090:50: + 4806 | *t1246*t3244*t1483 + | ^ +Warning: 't1168' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:21: - 1090 | *t155)*Clda)*sx - | ^ -Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:653:49: + 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 + | ^ +note: 't1168' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: - 653 | - 0.9e1_dp/0.4e1_dp*t22*t265*t248 - | ^ -Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: + 4737 | *t478*t183*t3918 + | ^ +Warning: 't1161' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:14: - 779 | t409*(t281 - t235*t41*t292)) - | ^ -Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:696:42: + 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 + | ^ +note: 't1161' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: - 696 | *(t262 - t235*t41*t248)) - | ^ -Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: + 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 + | ^ +Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:95: - 779 | t409*(t281 - t235*t41*t292)) - | ^ -Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:709:29: + 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't116' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4747:29: - 709 | t475 = t473*t87*t218 + 4747 | *t3382 | ^ -Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:701:23: +Warning: 't1157' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:89: - 701 | t429 = t86*t56 - | ^ -Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:696:42: + 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1157' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5300:57: - 696 | *(t262 - t235*t41*t248)) - | ^ -Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:696:42: Warning: 't77' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:722:23: + 5300 | t5864 = 0.1800000000e2_dp*t473*t1150*t4729 + | ^ +Warning: 't1150' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:82: - 722 | t541 = t73*t21 - | ^ -Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:772:38: + 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1150' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3959:50: - 772 | t677 = F1*t279*t34 - t71*t675 - | ^ -Warning: 't71' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 3959 | t1636 = 0.5600000000e2_dp*t624*t115 + | ^ +Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:75: - 767 | Clda)*sx - | ^ -Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: + 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't115' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5277:57: - 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx - | ^ -Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 5277 | t5801 = 0.3600000000e2_dp*t1143*t479*t5002 + | ^ +Warning: 't1143' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:69: - 767 | Clda)*sx - | ^ -Warning: 't64' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't58' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:701:23: + 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1143' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4738:33: - 701 | t429 = t86*t56 - | ^ -Warning: 't56' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 4738 | t4230 = t1142*t262 + | ^ +Warning: 't1142' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:62: - 767 | Clda)*sx - | ^ -Warning: 't52' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: + 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1142' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5385:63: - 779 | t409*(t281 - t235*t41*t292)) - | ^ -Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:645:48: + 5385 | t6074 = 0.8099999996e2_dp*t496*t4769*t1141*t4915 + | ^ +Warning: 't1141' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:55: - 645 | t255 = 0.2e1_dp/0.3e1_dp*t50*t125*t7*t4 - | ^ -Warning: 't50' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: + 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1141' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3391:81: - 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx + 3391 | t360 = 0.28e2_dp/0.3e1_dp*t122*t114 - 0.28e2_dp/0.3e1_dp*t356*t357 | ^ -Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: +Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:41: - 767 | Clda)*sx - | ^ -Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:628:24: + 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't114' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: - 628 | t217 = t216*t40 - | ^ -Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:664:27: + 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + | ^ +Warning: 't1137' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:35: - 664 | *t37*t292 - | ^ -Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1137' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: - 767 | Clda)*sx - | ^ -Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:658:24: + 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + | ^ +Warning: 't1134' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:28: - 658 | t280 = t279*t34 - | ^ -Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:705:33: + 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1134' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: - 705 | t445 = 0.1e1_dp/t117/t33 - | ^ -Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:720:25: + 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 + | ^ +Warning: 't1129' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:21: - 720 | t533 = t25*t31*C - | ^ -Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:643:63: + 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1129' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: - 643 | t248 = 4*t237*t229 + 5*t240*t27*t218 + 6*t244*t31*t218 - | ^ -Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:720:25: + 4726 | *t58*t3796*t71 + | ^ +Warning: 't1126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:14: - 720 | t533 = t25*t31*C - | ^ -Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:653:49: + 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1126' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: - 653 | - 0.9e1_dp/0.4e1_dp*t22*t265*t248 - | ^ -Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:715:24: + 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 + | ^ +Warning: 't1125' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:95: - 715 | t504 = t429*t21 - | ^ -Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1125' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: - 767 | Clda)*sx - | ^ -Warning: 't202' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: + 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + | ^ +Warning: 't1122' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:88: - 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx - | ^ -Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1122' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5191:33: - 767 | Clda)*sx - | ^ -Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:676:34: + 5191 | t5565 = t112*t1685 + | ^ +Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:81: - 676 | t349 = 0.1e1_dp/t347*t194 - | ^ -Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't112' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: - 767 | Clda)*sx - | ^ -Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:704:24: + 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 + | ^ +Warning: 't1119' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:75: - 704 | t437 = t227*t19 - | ^ -Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: + 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1119' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: - 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx - | ^ -Warning: 't187' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 4726 | *t58*t3796*t71 + | ^ +Warning: 't1111' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:68: - 767 | Clda)*sx - | ^ -Warning: 't183' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't181' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: + 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1111' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: - 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx - | ^ -Warning: 't178' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 + | ^ +Warning: 't1109' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:61: - 767 | Clda)*sx - | ^ -Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: + 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1109' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4712:66: - 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx - | ^ -Warning: 't175' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 4712 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 + | ^ +Warning: 't1106' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:54: - 767 | Clda)*sx - | ^ -Warning: 't173' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: + 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1106' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: - 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx - | ^ -Warning: 't170' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:641:22: + 4755 | t192*t68*t4256*t65 + | ^ +Warning: 't1101' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:47: - 641 | t240 = a4*t17 - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1101' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: - 767 | Clda)*sx - | ^ -Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't164' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't163' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't159' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: + 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 + | ^ +Warning: 't1100' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:40: - 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx - | ^ -Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1100' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3380:30: - 767 | Clda)*sx - | ^ -Warning: 't152' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: + 3380 | t332 = t11*t114 + | ^ +Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:33: - 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx - | ^ -Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: Warning: 't144' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:781:25: + 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't11' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: - 781 | t720 = t143*t269 - | ^ -Warning: 't143' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 4755 | t192*t68*t4256*t65 + | ^ +Warning: 't1097' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:21: - 767 | Clda)*sx - | ^ -Warning: 't142' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: + 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1097' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: - 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx - | ^ -Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 + | ^ +Warning: 't1093' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:14: - 767 | Clda)*sx - | ^ -Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:655:24: + 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1093' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: - 655 | t273 = t13*t269 - | ^ -Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 4806 | *t1246*t3244*t1483 + | ^ +Warning: 't1085' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:89: - 767 | Clda)*sx - | ^ -Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:644:34: + 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't1085' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3512:42: - 644 | t251 = t236*t125*t37*t248 - | ^ -Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 3512 | t635 = -4*t108 + 4*t332*rho + | ^ +Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:75: - 767 | Clda)*sx - | ^ -Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: + 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't108' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5090:57: - 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx - | ^ -Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:779:46: + 5090 | t5311 = 0.1666666668e0_dp*t289*t1071*t4701 + | ^ +Warning: 't1071' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:55: - 779 | t409*(t281 - t235*t41*t292)) - | ^ -Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:788:25: + 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't1071' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: - 788 | t808 = t118*t269 - | ^ -Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:705:33: + 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 + | ^ +Warning: 't107' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:48: - 705 | t445 = 0.1e1_dp/t117/t33 + 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't107' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4825:33: + + 4825 | t4575 = t1067*t561 | ^ -Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:729:25: +Warning: 't1067' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:35: - 729 | t612 = t429*t116 - | ^ -Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: + 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't1067' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: - 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx - | ^ -Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:767:34: + 4603 | *t3339 + | ^ +Warning: 't1064' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:28: - 767 | Clda)*sx - | ^ -Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:681:23: + 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't1064' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: - 681 | t373 = t73*t11 - | ^ -Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:822:81: + 4629 | *t321*t953*t1625 + | ^ +Warning: 't1063' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:21: - 822 | + 0.4e1_dp/0.9e1_dp*t195*qndrho*t199)*Clda)*sx - | ^ -Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:710:30: + 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't1063' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5497:40: - 710 | t479 = t108*t429*t331 - | ^ -Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:708:25: + 5497 | *t1054*t640*t3679 + | ^ +Warning: 't1060' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:14: - 708 | t473 = t424*t107 - | ^ -Warning: 't107' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:667:30: + 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't1060' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4233:31: - 667 | t314 = t312*t106*t107 - | ^ + 4233 | t2204 = t10*t106 + | ^ Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:726:25: - - 726 | t603 = t437*t105 - | ^ -Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F:724:29: - - 724 | t581 = t64*t118*t103 - | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xpbe_hole_t_c_lr.mod' due to: xc_xpbe_hole_t_c_lr.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xpbe_hole_t_c_lr.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathlib.mod mathconstants.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xbeef.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod cp_array_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F xc_xbeef.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:07:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbeef.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbeef.F90 -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F:489:109: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:95: - 489 | e_rho_spin(ii) = e_rho_spin(ii) + (SUM(e_leg*a)*e_ueg_drho + SUM(de_leg*a)*dt*ds_rho*e_ueg)*sx - | ^ -Warning: 'dt' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F:489:109: Warning: 'ds_rho' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F:490:89: + 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't106' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4927:59: - 490 | e_ndrho_spin(ii) = e_ndrho_spin(ii) + (SUM(de_leg*a)*dt*ds_ndrho*e_ueg)*sx - | ^ -Warning: 'ds_ndrho' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F:287:99: + 4927 | - 0.2400000000e2_dp*t786/t2492*t1058 + | ^ +Warning: 't1058' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:82: - 287 | e_rho(ii) = e_rho(ii) + (SUM(e_leg*a)*e_ueg_drho + SUM(de_leg*a)*dt*ds_rho*e_ueg)*sx - | ^ -Warning: 'dt' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F:287:99: Warning: 'ds_rho' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F:288:79: + 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't1058' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5172:67: - 288 | e_ndrho(ii) = e_ndrho(ii) + (SUM(de_leg*a)*dt*ds_ndrho*e_ueg)*sx - | ^ -Warning: 'ds_ndrho' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xbeef.mod' due to: xc_xbeef.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xbeef.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod cp_array_utils.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_libxc_wrap.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_libxc_wrap.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_log_handling.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_libxc_wrap.F xc_libxc_wrap.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:07:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_libxc_wrap.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_libxc_wrap.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_libxc_wrap.mod' due to: xc_libxc_wrap.o /build/reproducible-path/cp2k-8.1/src/xc/xc_libxc_wrap.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_log_handling.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_libxc.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_libxc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_libxc_wrap.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_libxc.F xc_libxc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:07:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_libxc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_libxc.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_libxc.mod' due to: xc_libxc.o /build/reproducible-path/cp2k-8.1/src/xc/xc_libxc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_libxc_wrap.mod base_hooks.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xlda_hole_t_c_lr.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathlib.mod mathconstants.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F xc_xlda_hole_t_c_lr.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:08:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xlda_hole_t_c_lr.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xlda_hole_t_c_lr.F90 -/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: + 5172 | *t5511 + 0.1200000000e3_dp*t1055*t2565*t4721 + | ^ +Warning: 't1055' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:68: - 291 | /0.3e1_dp - C*t15*t3*t6*t4*t25))*sx - | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xlda_hole_t_c_lr.mod' due to: xc_xlda_hole_t_c_lr.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathlib.mod mathconstants.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xbr_pbe_lda_hole_t_c_lr.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xbr_pbe_lda_hole_t_c_lr.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_xbecke_roussel.mod mathconstants.mod xc_xlda_hole_t_c_lr.mod xc_xpbe_hole_t_c_lr.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xbr_pbe_lda_hole_t_c_lr.F xc_xbr_pbe_lda_hole_t_c_lr.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:08:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbr_pbe_lda_hole_t_c_lr.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbr_pbe_lda_hole_t_c_lr.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xbr_pbe_lda_hole_t_c_lr.mod' due to: xc_xbr_pbe_lda_hole_t_c_lr.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xbr_pbe_lda_hole_t_c_lr.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_xbecke_roussel.mod mathconstants.mod xc_xlda_hole_t_c_lr.mod xc_xpbe_hole_t_c_lr.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_lyp.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_lyp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_lyp.F xc_lyp.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:08:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_lyp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_lyp.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_lyp.mod' due to: xc_lyp.o /build/reproducible-path/cp2k-8.1/src/xc/xc_lyp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_pbe.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod xc_input_constants.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F xc_pbe.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:08:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_pbe.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_pbe.F90 -/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1923:38: + 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't1055' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5497:40: - 1923 | t477 = 0.1e1_dp/t475*mu - | ^ -Warning: 'mu' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1524:25: + 5497 | *t1054*t640*t3679 + | ^ +Warning: 't1054' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:61: - 1524 | kf_brhobrhob, mu - | ^ -note: 'mu' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1735:51: + 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't1054' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: - 1735 | Fx_b = 0.1e1_dp + kappa - kappa/t153 - | ^ -Warning: 'kappa' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1523:42: + 4622 | *t786*t1034*t1681 + | ^ +Warning: 't1050' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:54: - 1523 | k_s1rhob, k_srhoa, k_srhob, kappa, kf_a, kf_arhoa, kf_arhoarhoa, kf_b, kf_brhob, & - | ^ -note: 'kappa' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1692:31: + 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't1050' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3337:31: - 1692 | t101 = beta*t100 + 3337 | t234 = t105*t233 | ^ -Warning: 'beta' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1512:24: +Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:47: - 1512 | Arhobrhob, beta, beta_1_1, beta_1_2, beta_1_3, beta_2_1, beta_2_2, beta_2_3, beta_3_1, & - | ^ -note: 'beta' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1108:55: + 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't105' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: - 1108 | t1385 = 0.1e1_dp/t1380*t469*mu*t101*s - | ^ -Warning: 'mu' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:431:24: + 4613 | + 0.3200000000e2_dp*t1055*t3674 + | ^ +Warning: 't1046' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:41: - 431 | kfrhorhorho, mu, my_norm_drho, my_rho, p_1, p_2, rs, rs2rho, rsrho, rsrhorho, & - | ^ -note: 'mu' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:1109:34: + 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't1046' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: - 1109 | t1386 = kappa**2 + 4613 | + 0.3200000000e2_dp*t1055*t3674 + | ^ +Warning: 't1044' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:34: + + 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ -Warning: 'kappa' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:430:66: +note: 't1044' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3371:30: - 430 | k_s1rhorho, k_s2rho, k_srho, k_srho1rho, k_srhorho, kappa, kf, kf2rho, kfrho, kfrhorho, & - | ^ -note: 'kappa' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:956:34: + 3371 | t316 = t97*t104 + | ^ +Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:20: - 956 | t879 = beta/t877 - | ^ -Warning: 'beta' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F:423:25: + 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't104' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: - 423 | Arhorhorho, beta, beta_1_1, beta_2_1, beta_3_1, beta_4_1, e_c_u_0, e_c_u_01rho, & - | ^ -note: 'beta' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_pbe.mod' due to: xc_pbe.o /build/reproducible-path/cp2k-8.1/src/xc/xc_pbe.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod xc_input_constants.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_sr_lda.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_sr_lda.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_functionals_utilities.mod mathconstants.mod base_hooks.mod xc_input_constants.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_sr_lda.F xc_sr_lda.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:08:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_sr_lda.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_sr_lda.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_sr_lda.mod' due to: xc_sr_lda.o /build/reproducible-path/cp2k-8.1/src/xc/xc_sr_lda.F /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_functionals_utilities.mod mathconstants.mod base_hooks.mod xc_input_constants.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xalpha.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xalpha.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod cp_array_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xalpha.F xc_xalpha.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:08:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xalpha.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xalpha.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xalpha.mod' due to: xc_xalpha.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xalpha.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod cp_array_utils.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_cs1.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_cs1.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_cs1.F xc_cs1.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:08:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_cs1.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_cs1.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_cs1.mod' due to: xc_cs1.o /build/reproducible-path/cp2k-8.1/src/xc/xc_cs1.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_optx.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_optx.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod cp_array_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_optx.F xc_optx.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:08:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_optx.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_optx.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_optx.mod' due to: xc_optx.o /build/reproducible-path/cp2k-8.1/src/xc/xc_optx.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod base_hooks.mod cp_array_utils.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_perdew_zunger.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod xc_input_constants.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F xc_perdew_zunger.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:08:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_perdew_zunger.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_perdew_zunger.F90 -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:714:74: + 4622 | *t786*t1034*t1681 + | ^ +Warning: 't1036' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:14: - 714 | + trz*r(1)*z(0, 2) + tzz*z(0, 2)*z(1, 0) + tz*z(1, 2) - | ^ -Warning: 'tzz' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:617:63: + 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't1036' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: - 617 | tzz, tzzz - | ^ -note: 'tzz' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:682:56: + 4622 | *t786*t1034*t1681 + | ^ +Warning: 't1034' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:96: - 682 | + tr*r(2) + tzz*z(1, 0)**2 + tz*z(2, 0) - | ^ -Warning: 'trz' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:89: + 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't1034' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: - 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -note: 'trz' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:682:56: + 4622 | *t786*t1034*t1681 + | ^ +Warning: 't1030' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:82: - 682 | + tr*r(2) + tzz*z(1, 0)**2 + tz*z(2, 0) - | ^ -Warning: 'trr' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:72: + 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't1030' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3648:29: - 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -note: 'trr' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:675:41: + 3648 | t972 = t103**2 + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:75: - 675 | ed(m + 1) = tr*r(1) + tz*z(0, 1) - | ^ -Warning: 'tz' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:99: + 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't103' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: - 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -note: 'tz' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:673:37: + 4622 | *t786*t1034*t1681 + | ^ +Warning: 't1026' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:69: - 673 | ed(m) = tr*r(1) + tz*z(1, 0) - | ^ -Warning: 'tr' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:67: + 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't1026' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: - 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -note: 'tr' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:720:62: + 4622 | *t786*t1034*t1681 + | ^ +Warning: 't1024' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:62: - 720 | + 3.0_dp*tzz*z(0, 1)*z(0, 2) + tz*z(0, 3) + 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ -Warning: 'tzzz' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:617:69: +note: 't1024' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: - 617 | tzz, tzzz - | ^ -note: 'tzzz' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:706:74: + 4622 | *t786*t1034*t1681 + | ^ +Warning: 't1021' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:55: - 706 | + trz*r(1)*z(2, 0) + tzz*z(2, 0)*z(0, 1) + tz*z(2, 1) - | ^ -Warning: 'trzz' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:95: + 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't1021' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5175:43: - 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -note: 'trzz' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:698:58: + 5175 | t5528 = t102*t327*t1684*t557 + | ^ +Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:48: - 698 | + 3.0_dp*tzz*z(1, 0)*z(2, 0) + tz*z(3, 0) - | ^ -Warning: 'trrz' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:84: + 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't102' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4536:32: - 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -note: 'trrz' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:698:58: + 4536 | t12*t1058 + | ^ +Warning: 't1014' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:35: - 698 | + 3.0_dp*tzz*z(1, 0)*z(2, 0) + tz*z(3, 0) - | ^ -Warning: 'trrr' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:78: + 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't1014' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: - 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & - | ^ -note: 'trrr' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_perdew_zunger.mod' due to: xc_perdew_zunger.o /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod xc_input_constants.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xbecke88_lr_adiabatic.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod cp_array_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F xc_xbecke88_lr_adiabatic.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:08:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbecke88_lr_adiabatic.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbecke88_lr_adiabatic.F90 + 4622 | *t786*t1034*t1681 + | ^ +Warning: 't1012' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:28: + + 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't1012' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: + + 4622 | *t786*t1034*t1681 + | ^ +Warning: 't1008' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:21: + + 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't1008' was declared here /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: 4613 | + 0.3200000000e2_dp*t1055*t3674 | ^ +Warning: 't1004' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:14: + + 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't1004' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: + + 4603 | *t3339 + | ^ +Warning: 't1000' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3047:84: + + 3047 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, ndrho, rho, t1, t10, t1000, t1002, & + | ^ +note: 't1000' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3667:50: + + 3667 | t1019 = 0.1e1_dp/t19/t1014*t787*t10 + | ^ +Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3047:77: + + 3047 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, ndrho, rho, t1, t10, t1000, t1002, & + | ^ +note: 't10' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: + + 1841 | + 0.3200000000e2_dp*t1055*t3674 + | ^ Warning: 't997' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3175:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:400:30: - 3175 | t99, t991, t995, t997, xx + 400 | t99, t991, t995, t997, xx | ^ note: 't997' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5160:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2388:54: - 5160 | t5487 = 0.2160000000e3_dp*t7*t995*t1652 + 2388 | t5487 = 0.2160000000e3_dp*t7*t995*t1652 | ^ Warning: 't995' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3175:24: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:400:24: - 3175 | t99, t991, t995, t997, xx + 400 | t99, t991, t995, t997, xx | ^ note: 't995' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: - 4613 | + 0.3200000000e2_dp*t1055*t3674 + 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: 't991' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3175:18: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:400:18: - 3175 | t99, t991, t995, t997, xx + 400 | t99, t991, t995, t997, xx | ^ note: 't991' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: - 5031 | *t105*t5118 + 2259 | *t105*t5118 | ^ Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3175:12: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:400:12: - 3175 | t99, t991, t995, t997, xx + 400 | t99, t991, t995, t997, xx | ^ note: 't99' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: - 4613 | + 0.3200000000e2_dp*t1055*t3674 + 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: 't987' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:95: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:95: - 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: 't987' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: - 4603 | *t3339 + 1831 | *t3339 | ^ Warning: 't984' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:89: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:89: - 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: 't984' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: 't980' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:77: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:77: - 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: 't980' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5190:50: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2418:50: - 5190 | t5564 = 0.1173333333e3_dp*t5060*t98 + 2418 | t5564 = 0.1173333333e3_dp*t5060*t98 | ^ Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:71: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:71: - 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: 't98' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: - 4637 | *t339*t969 + 1865 | *t339*t969 | ^ Warning: 't976' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:60: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:60: - 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: 't976' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: - 4629 | *t321*t953*t1625 + 1857 | *t321*t953*t1625 | ^ Warning: 't974' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:48: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:48: - 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: 't974' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: - 4637 | *t339*t969 + 1865 | *t339*t969 | ^ Warning: 't973' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:42: - 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: 't973' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3510:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:738:30: - 3510 | t627 = t97*t132 + 738 | t627 = t97*t132 | ^ Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:30: - 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: 't97' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: - 4637 | *t339*t969 + 1865 | *t339*t969 | ^ Warning: 't969' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:25: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:25: - 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: 't969' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: 't966' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:19: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:19: - 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: 't966' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: - 4603 | *t3339 + 1831 | *t3339 | ^ Warning: 't963' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3174:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:13: - 3174 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & + 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & | ^ note: 't963' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: - 4637 | *t339*t969 + 1865 | *t339*t969 | ^ Warning: 't962' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:92: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:92: - 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: 't962' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: - 4603 | *t3339 + 1831 | *t3339 | ^ Warning: 't959' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:86: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:86: - 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: 't959' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: 't955' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:74: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:74: - 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: 't955' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5201:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2429:56: - 5201 | t5593 = 0.1066666667e2_dp*t321*t953*t5087 + 2429 | t5593 = 0.1066666667e2_dp*t321*t953*t5087 | ^ Warning: 't953' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:62: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:62: - 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: 't953' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: - 4637 | *t339*t969 + 1865 | *t339*t969 | ^ Warning: 't950' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:56: - 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: 't950' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3383:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:611:38: - 3383 | t341 = 0.1e1_dp/t19/t95 + 611 | t341 = 0.1e1_dp/t19/t95 | ^ Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:50: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:50: - 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: 't95' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5207:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2435:56: - 5207 | t5607 = 0.5866666667e2_dp*t307*t949*t5069 + 2435 | t5607 = 0.5866666667e2_dp*t307*t949*t5069 | ^ Warning: 't949' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:45: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:45: - 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: 't949' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: 't946' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3173:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:39: - 3173 | REAL(kind=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & + 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & | ^ note: 't946' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: - 4629 | *t321*t953*t1625 + 1857 | *t321*t953*t1625 | ^ Warning: 't941' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:76: - 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: 't941' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4615:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1843:31: - 4615 | t3682 = t24*t940 + 1843 | t3682 = t24*t940 | ^ Warning: 't940' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:70: - 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: 't940' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4238:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1466:70: - 4238 | *t371 - 0.4266666668e2_dp*t2220/t1014/t94*t1058 + 1466 | *t371 - 0.4266666668e2_dp*t2220/t1014/t94*t1058 | ^ Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:64: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:64: - 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: 't94' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: - 4637 | *t339*t969 + 1865 | *t339*t969 | ^ Warning: 't930' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:59: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:59: - 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: 't930' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5189:50: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2417:50: - 5189 | t5562 = 0.5866666667e2_dp*t93*t4820 + 2417 | t5562 = 0.5866666667e2_dp*t93*t4820 | ^ Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:53: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:53: - 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: 't93' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: 't929' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:48: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:48: - 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: 't929' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4665:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1893:39: - 4665 | *t165*t3865*t237 + 1893 | *t165*t3865*t237 | ^ Warning: 't922' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:30: - 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: 't922' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3362:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:590:29: - 3362 | t298 = t92*t97 + 590 | t298 = t92*t97 | ^ Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:24: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:24: - 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: 't92' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: - 4851 | *t289*t294*t1553 + 2079 | *t289*t294*t1553 | ^ Warning: 't918' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:19: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:19: - 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: 't918' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: - 4859 | *t83*t45*t3581*t140 + 2087 | *t83*t45*t3581*t140 | ^ Warning: 't914' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3172:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:13: - 3172 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 | ^ note: 't914' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4798:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2026:66: - 4798 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 + 2026 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 | ^ Warning: 't907' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:94: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:94: - 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: 't907' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: - 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 + 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 | ^ Warning: 't906' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:88: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:88: - 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: 't906' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3961:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1189:39: - 3961 | t1640 = 0.1e1_dp/t787/t9 + 1189 | t1640 = 0.1e1_dp/t787/t9 | ^ Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:76: - 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: 't9' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5442:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2670:57: - 5442 | t6216 = 0.8333333340e-1_dp*t429*t897*t4701 + 2670 | t6216 = 0.8333333340e-1_dp*t429*t897*t4701 | ^ Warning: 't897' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:72: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:72: - 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: 't897' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: - 4870 | t3869 + t4657 + t4696) + 2098 | t3869 + t4657 + t4696) | ^ Warning: 't893' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:60: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:60: - 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: 't893' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4719:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1947:70: - 4719 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 + 1947 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 | ^ Warning: 't886' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:48: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:48: - 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: 't886' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4719:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1947:70: - 4719 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 + 1947 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 | ^ Warning: 't882' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:42: - 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: 't882' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3521:49: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:749:49: - 3521 | *t615 - 0.20e1_dp*t102*t646 + 749 | *t615 - 0.20e1_dp*t102*t646 | ^ Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:30: - 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: 't88' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: - 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: 't878' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:25: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:25: - 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: 't878' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: - 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: 't874' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3171:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:13: - 3171 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & | ^ note: 't874' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: - 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 + 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 | ^ Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:93: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:93: - 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: 't87' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: - 4726 | *t58*t3796*t71 + 1954 | *t58*t3796*t71 | ^ Warning: 't866' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:82: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:82: - 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: 't866' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: - 4755 | t192*t68*t4256*t65 + 1983 | t192*t68*t4256*t65 | ^ Warning: 't865' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:76: - 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: 't865' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4712:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1940:66: - 4712 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 + 1940 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 | ^ Warning: 't864' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:70: - 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: 't864' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: - 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 | ^ Warning: 't863' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:64: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:64: - 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: 't863' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: - 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:52: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:52: - 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: 't86' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4747:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1975:29: - 4747 | *t3382 + 1975 | *t3382 | ^ Warning: 't859' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:47: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:47: - 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: 't859' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4559:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1787:56: - 4559 | t3497 = 0.2400000000e2_dp*t473*t852*t1483 + 1787 | t3497 = 0.2400000000e2_dp*t473*t852*t1483 | ^ Warning: 't852' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:29: - 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: 't852' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4238:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1466:70: - 4238 | *t371 - 0.4266666668e2_dp*t2220/t1014/t94*t1058 + 1466 | *t371 - 0.4266666668e2_dp*t2220/t1014/t94*t1058 | ^ Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:17: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:17: - 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: 't85' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3485:108: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:713:98: - 3485 | t46*t541))*sx - | ^ + 713 | t46*t541))*sx + | ^ Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3170:12: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:12: - 3170 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & + 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & | ^ note: 't84' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4833:71: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2061:71: - 4833 | *t3507 - t3512)*t149*t160 + 2061 | *t3507 - t3512)*t149*t160 | ^ Warning: 't833' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:94: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:94: - 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: 't833' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5426:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2654:37: - 5426 | t6175 = t83*t597*t1688 + 2654 | t6175 = t83*t597*t1688 | ^ Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:88: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:88: - 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: 't83' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4555:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1783:38: - 4555 | t165*t171*t3449 + 1783 | t165*t171*t3449 | ^ Warning: 't827' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:83: - 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: 't827' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4682:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1910:40: - 4682 | *t400*t1333*t1410 + 1910 | *t400*t1333*t1410 | ^ Warning: 't822' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:71: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:71: - 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: 't822' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4555:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1783:38: - 4555 | t165*t171*t3449 + 1783 | t165*t171*t3449 | ^ Warning: 't815' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:65: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:65: - 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: 't815' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: - 4870 | t3869 + t4657 + t4696) + 2098 | t3869 + t4657 + t4696) | ^ Warning: 't804' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:59: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:59: - 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: 't804' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: 't801' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:53: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:53: - 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: 't801' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: 't800' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:47: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:47: - 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: 't800' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3558:118: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:786:108: - 3558 | *t83*t653 - 0.2222222224e0_dp*t144*t46*t739))*sx - | ^ + 786 | *t83*t653 - 0.2222222224e0_dp*t144*t46*t739))*sx + | ^ Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:41: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:41: - 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: 't8' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4536:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1764:32: - 4536 | t12*t1058 + 1764 | t12*t1058 | ^ Warning: 't797' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3169:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:37: - 3169 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & + 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & | ^ note: 't797' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3485:108: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:713:98: - 3485 | t46*t541))*sx - | ^ + 713 | t46*t541))*sx + | ^ Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:95: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:95: - 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: 't79' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4879:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2107:42: - 4879 | t4721 = 0.1e1_dp/t787*t2480 + 2107 | t4721 = 0.1e1_dp/t787*t2480 | ^ Warning: 't787' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:90: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:90: - 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: 't787' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4927:59: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2155:59: - 4927 | - 0.2400000000e2_dp*t786/t2492*t1058 + 2155 | - 0.2400000000e2_dp*t786/t2492*t1058 | ^ Warning: 't786' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:84: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:84: - 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: 't786' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4536:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1764:32: - 4536 | t12*t1058 + 1764 | t12*t1058 | ^ Warning: 't782' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:72: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:72: - 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: 't782' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: - 4516 | + t3288) + 1744 | + t3288) | ^ Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:66: - 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: 't78' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4670:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1898:32: - 4670 | t3925 = t777*t561 + 1898 | t3925 = t777*t561 | ^ Warning: 't777' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:61: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:61: - 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: 't777' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: - 4603 | *t3339 + 1831 | *t3339 | ^ Warning: 't773' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:49: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:49: - 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: 't773' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: - 4629 | *t321*t953*t1625 + 1857 | *t321*t953*t1625 | ^ Warning: 't772' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:43: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:43: - 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: 't772' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: 't769' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:37: - 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: 't769' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4542:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1770:57: - 4542 | *t102*t3363 - 0.20e1_dp*t102*t3379 + 1770 | *t102*t3363 - 0.20e1_dp*t102*t3379 | ^ Warning: 't766' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:31: - 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: 't766' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: - 4613 | + 0.3200000000e2_dp*t1055*t3674 + 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: 't764' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:19: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:19: - 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: 't764' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: - 4870 | t3869 + t4657 + t4696) + 2098 | t3869 + t4657 + t4696) | ^ Warning: 't754' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3168:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:13: - 3168 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & | ^ note: 't754' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: - 4870 | t3869 + t4657 + t4696) + 2098 | t3869 + t4657 + t4696) | ^ Warning: 't753' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:95: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:95: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't753' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4884:55: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2112:55: - 4884 | t4732 = 0.6666666672e0_dp*t747*t84*t4729 + 2112 | t4732 = 0.6666666672e0_dp*t747*t84*t4729 | ^ Warning: 't747' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:89: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:89: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't747' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3433:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:661:32: - 3433 | t446 = t74*rho - | ^ + 661 | t446 = t74*my_rho + | ^ Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:83: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't74' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3991:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1219:31: - 3991 | t1694 = t45*t739 + 1219 | t1694 = t45*t739 | ^ Warning: 't739' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:78: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:78: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't739' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4791:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2019:39: - 4791 | *t429*t1928*t290 + 2019 | *t429*t1928*t290 | ^ Warning: 't735' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:72: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:72: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't735' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5379:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2607:33: - 5379 | t6053 = t732*t6052 + 2607 | t6053 = t732*t6052 | ^ Warning: 't732' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:66: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't732' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5344:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2572:51: - 5344 | t5977 = 0.1111111112e0_dp*t1755*t729 + 2572 | t5977 = 0.1111111112e0_dp*t1755*t729 | ^ Warning: 't729' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:60: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:60: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't729' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4712:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1940:66: - 4712 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 + 1940 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 | ^ Warning: 't728' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:54: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't728' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5386:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2614:33: - 5386 | t6075 = t723*t6052 + 2614 | t6075 = t723*t6052 | ^ Warning: 't723' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:48: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:48: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't723' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5557:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2785:54: - 5557 | + t5949 + t5952 + t5954 - t5958 + 2785 | + t5949 + t5952 + t5954 - t5958 | ^ Warning: 't722' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:42: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't722' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5357:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2585:33: - 5357 | t6006 = t719*t1838 + 2585 | t6006 = t719*t1838 | ^ Warning: 't719' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:36: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:36: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't719' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5065:90: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2293:90: - 5065 | t729 - 0.5555555558e-1_dp*t192*t5271 - 0.5000000001e0_dp*t732*t4908 + 2293 | t729 - 0.5555555558e-1_dp*t192*t5271 - 0.5000000001e0_dp*t732*t4908 | ^ Warning: 't716' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:30: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't716' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4003:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1231:31: - 4003 | t1715 = t713*t67 + 1231 | t1715 = t713*t67 | ^ Warning: 't713' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:24: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:24: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't713' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4049:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1277:51: - 4049 | t1797 = 0.8999999998e1_dp*t1795*t710 + 1277 | t1797 = 0.8999999998e1_dp*t1795*t710 | ^ Warning: 't710' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:18: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:18: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't710' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3549:87: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:777:87: - 3549 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 + 777 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 | ^ Warning: 't71' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3167:12: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:12: - 3167 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & | ^ note: 't71' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4040:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1268:51: - 4040 | t1779 = 0.5000000001e0_dp*t1777*t709 + 1268 | t1779 = 0.5000000001e0_dp*t1777*t709 | ^ Warning: 't709' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:93: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:93: - 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: 't709' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5065:90: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2293:90: - 5065 | t729 - 0.5555555558e-1_dp*t192*t5271 - 0.5000000001e0_dp*t732*t4908 + 2293 | t729 - 0.5555555558e-1_dp*t192*t5271 - 0.5000000001e0_dp*t732*t4908 | ^ Warning: 't708' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:87: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:87: - 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: 't708' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4197:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1425:33: - 4197 | t2114 = t707*t2113 + 1425 | t2114 = t707*t2113 | ^ Warning: 't707' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:81: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:81: - 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: 't707' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5384:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2612:42: - 5384 | t6066 = t1519*t705*t561*t65 + 2612 | t6066 = t1519*t705*t561*t65 | ^ Warning: 't705' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:75: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:75: - 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: 't705' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: - 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:69: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:69: - 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: 't70' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3374:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:602:29: - 3374 | t321 = t7*t219 + 602 | t321 = t7*t219 | ^ Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:64: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:64: - 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: 't7' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4451:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1679:30: - 4451 | t3097 = t66*t69 + 1679 | t3097 = t66*t69 | ^ Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:60: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:60: - 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: 't69' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4118:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1346:56: - 4118 | t1952 = 0.5555555557e-1_dp*t165*t689*t433 + 1346 | t1952 = 0.5555555557e-1_dp*t165*t689*t433 | ^ Warning: 't689' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:55: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:55: - 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: 't689' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3419:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:647:30: - 3419 | t406 = t68*t140 + 647 | t406 = t68*t140 | ^ Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:49: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:49: - 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: 't68' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4907:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2135:73: - 4907 | *t165*t166*t4729 + 0.3333333334e0_dp*t55*t57*t4782 + 2135 | *t165*t166*t4729 + 0.3333333334e0_dp*t55*t57*t4782 | ^ Warning: 't679' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:44: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:44: - 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: 't679' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: - 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) + 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) | ^ Warning: 't673' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:38: - 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: 't673' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5418:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2646:38: - 5418 | t6160 = t147*t1885*t672 + 2646 | t6160 = t147*t1885*t672 | ^ Warning: 't672' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3166:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:32: - 3166 | REAL(kind=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & | ^ note: 't672' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4139:55: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1367:55: - 4139 | t1997 = 0.1666666667e0_dp*t165*t171*t668 + 1367 | t1997 = 0.1666666667e0_dp*t165*t171*t668 | ^ Warning: 't668' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3165:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:390:76: - 3165 | t6603, t6611, t6620, t6621, t6630, t6640, t6658, t6665, t6669, t668 + 390 | t6603, t6611, t6620, t6621, t6630, t6640, t6658, t6665, t6669, t668 | ^ note: 't668' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3458:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:686:30: - 3458 | t516 = t66*t515 + 686 | t516 = t66*t515 | ^ Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3164:92: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:389:92: - 3164 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & + 389 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & | ^ note: 't66' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5414:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2642:38: - 5414 | t6141 = t658*t575*t1925 + 2642 | t6141 = t658*t575*t1925 | ^ Warning: 't658' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3164:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:389:73: - 3164 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & + 389 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & | ^ note: 't658' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3990:49: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1218:49: - 3990 | t1693 = 0.3333333336e0_dp*t55*t653 + 1218 | t1693 = 0.3333333336e0_dp*t55*t653 | ^ Warning: 't653' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3164:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:389:33: - 3164 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & + 389 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & | ^ note: 't653' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3903:49: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1131:49: - 3903 | t1545 = 0.3333333336e0_dp*t55*t650 + 1131 | t1545 = 0.3333333336e0_dp*t55*t650 | ^ Warning: 't650' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3164:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:389:13: - 3164 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & + 389 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & | ^ note: 't650' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3497:59: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:725:59: - 3497 | *t71 - 0.5000000001e0_dp*t60*t561*t65 + 725 | *t71 - 0.5000000001e0_dp*t60*t561*t65 | ^ Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3163:93: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:388:93: - 3163 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & + 388 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & | ^ note: 't65' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4096:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1324:31: - 4096 | t1902 = t68*t649 + 1324 | t1902 = t68*t649 | ^ Warning: 't649' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3163:74: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:388:74: - 3163 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & + 388 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & | ^ note: 't649' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: - 5031 | *t105*t5118 + 2259 | *t105*t5118 | ^ Warning: 't646' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3163:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:388:54: - 3163 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & + 388 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & | ^ note: 't646' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5197:53: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2425:53: - 5197 | t5579 = 0.80e1_dp*t102*t327*t645*t1443 + 2425 | t5579 = 0.80e1_dp*t102*t327*t645*t1443 | ^ Warning: 't645' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3163:41: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:388:41: - 3163 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & + 388 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & | ^ note: 't645' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4169:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1397:32: - 4169 | t2054 = t786*t640 + 1397 | t2054 = t786*t640 | ^ Warning: 't640' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3162:88: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:387:88: - 3162 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & + 387 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & | ^ note: 't640' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: - 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: 't637' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3162:47: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:387:47: - 3162 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & + 387 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & | ^ note: 't637' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: - 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: 't635' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3162:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:387:20: - 3162 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & + 387 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & | ^ note: 't635' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: - 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: 't628' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3161:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:386:40: - 3161 | t6267, t6268, t627, t6271, t628, t6281, t6283, t6290, t6291, t63, t6308, t6338, t6339, & + 386 | t6267, t6268, t627, t6271, t628, t6281, t6283, t6290, t6291, t63, t6308, t6338, t6339, & | ^ note: 't628' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5157:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2385:51: - 5157 | t5480 = 0.1760000000e3_dp*t5060*t627 + 2385 | t5480 = 0.1760000000e3_dp*t5060*t627 | ^ Warning: 't627' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3161:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:386:27: - 3161 | t6267, t6268, t627, t6271, t628, t6281, t6283, t6290, t6291, t63, t6308, t6338, t6339, & + 386 | t6267, t6268, t627, t6271, t628, t6281, t6283, t6290, t6291, t63, t6308, t6338, t6339, & | ^ note: 't627' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5200:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2428:56: - 5200 | t5590 = 0.80e1_dp*t624*t22*t326*t136*t233 + 2428 | t5590 = 0.80e1_dp*t624*t22*t326*t136*t233 | ^ Warning: 't624' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3160:41: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:385:41: - 3160 | t6219, t6222, t6223, t6227, t624, t6247, t6249, t6252, t6253, t6256, t6257, t6260, t6263, & + 385 | t6219, t6222, t6223, t6227, t624, t6247, t6249, t6252, t6253, t6256, t6257, t6260, t6263, & | ^ note: 't624' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3450:35: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:678:35: - 3450 | *t61*t262*t25 + 678 | *t61*t262*t25 | ^ Warning: 't62' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3159:61: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:384:61: - 3159 | REAL(kind=dp) :: t6186, t6189, t6192, t6194, t6198, t62, t6201, t6207, t6210, t6213, t6216, & + 384 | REAL(KIND=dp) :: t6186, t6189, t6192, t6194, t6198, t62, t6201, t6207, t6210, t6213, t6216, & | ^ note: 't62' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: - 5031 | *t105*t5118 + 2259 | *t105*t5118 | ^ Warning: 't615' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3157:96: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:382:96: - 3157 | t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & + 382 | t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & | ^ note: 't615' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3940:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1168:32: - 3940 | t1608 = t953*t614 + 1168 | t1608 = t953*t614 | ^ Warning: 't614' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3157:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:382:76: - 3157 | t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & + 382 | t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & | ^ note: 't614' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3345:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:573:34: - 3345 | t264 = t61*t262*t17 + 573 | t264 = t61*t262*t17 | ^ Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3156:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:381:73: - 3156 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & + 381 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & | ^ note: 't61' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: - 5031 | *t105*t5118 + 2259 | *t105*t5118 | ^ Warning: 't609' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3156:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:381:40: - 3156 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & + 381 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & | ^ note: 't609' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3929:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1157:32: - 3929 | t1592 = t949*t608 + 1157 | t1592 = t949*t608 | ^ Warning: 't608' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3156:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:381:27: - 3156 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & + 381 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & | ^ note: 't608' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: 't605' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3155:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:380:34: - 3155 | t6044, t6047, t6049, t605, t6052, t6053, t6056, t6058, t6060, t6063, t6066, t6074, t6075, & + 380 | t6044, t6047, t6049, t605, t6052, t6053, t6056, t6058, t6060, t6063, t6066, t6074, t6075, & | ^ note: 't605' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4037:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1265:31: - 4037 | t1774 = t60*t496 + 1265 | t1774 = t60*t496 | ^ Warning: 't60' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3153:64: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:378:64: - 3153 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & + 378 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & | ^ note: 't60' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3393:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:621:33: - 3393 | t365 = t6*ndrho - | ^ + 621 | t365 = t6*my_ndrho + | ^ Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3153:59: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:378:59: - 3153 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & + 378 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & | ^ note: 't6' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3902:49: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1130:49: - 3902 | t1543 = 0.3333333336e0_dp*t55*t598 + 1130 | t1543 = 0.3333333336e0_dp*t55*t598 | ^ Warning: 't598' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3153:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:378:27: - 3153 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & + 378 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & | ^ note: 't598' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5426:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2654:37: - 5426 | t6175 = t83*t597*t1688 + 2654 | t6175 = t83*t597*t1688 | ^ Warning: 't597' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3152:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:377:76: - 3152 | REAL(kind=dp) :: t5954, t5956, t5958, t5960, t5963, t5964, t5966, t597, t5971, t5973, t5975, & + 377 | REAL(KIND=dp) :: t5954, t5956, t5958, t5960, t5963, t5964, t5966, t597, t5971, t5973, t5975, & | ^ note: 't597' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4135:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1363:56: - 4135 | t1987 = 0.8333333335e-1_dp*t429*t437*t593 + 1363 | t1987 = 0.8333333335e-1_dp*t429*t437*t593 | ^ Warning: 't593' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3151:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:376:20: - 3151 | t5929, t593, t5932, t5938, t5940, t5942, t5944, t5949, t5952 + 376 | t5929, t593, t5932, t5938, t5940, t5942, t5944, t5949, t5952 | ^ note: 't593' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3840:50: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1068:50: - 3840 | t1408 = 0.4444444448e0_dp*t214*t590 + 1068 | t1408 = 0.4444444448e0_dp*t214*t590 | ^ Warning: 't590' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3150:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:375:32: - 3150 | t5891, t5898, t59, t590, t5902, t5905, t5908, t5911, t5913, t5918, t5922, t5925, t5926, & + 375 | t5891, t5898, t59, t590, t5902, t5905, t5908, t5911, t5913, t5918, t5922, t5925, t5926, & | ^ note: 't590' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3534:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:762:30: - 3534 | t707 = t187*t59 + 762 | t707 = t187*t59 | ^ Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3150:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:375:26: - 3150 | t5891, t5898, t59, t590, t5902, t5905, t5908, t5911, t5913, t5918, t5922, t5925, t5926, & + 375 | t5891, t5898, t59, t590, t5902, t5905, t5908, t5911, t5913, t5918, t5922, t5925, t5926, & | ^ note: 't59' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4917:60: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2145:60: - 4917 | t4812 = 0.1333333334e1_dp*t217*t46*t589*t1447 + 2145 | t4812 = 0.1333333334e1_dp*t217*t46*t589*t1447 | ^ Warning: 't589' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3149:97: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:374:97: - 3149 | t5850, t5854, t5857, t5861, t5864, t5868, t5869, t5875, t5880, t5881, t5885, t5888, t589, & + 374 | t5850, t5854, t5857, t5861, t5864, t5868, t5869, t5875, t5880, t5881, t5885, t5888, t589, & | ^ note: 't589' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4122:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1350:34: - 4122 | t1962 = t585*rho - | ^ + 1350 | t1962 = t585*my_rho + | ^ Warning: 't585' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3148:97: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:373:97: - 3148 | t5819, t5822, t5825, t5828, t5830, t5831, t5833, t5835, t5838, t5841, t5845, t5848, t585, & + 373 | t5819, t5822, t5825, t5828, t5830, t5831, t5833, t5835, t5838, t5841, t5845, t5848, t585, & | ^ note: 't585' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3348:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:576:30: - 3348 | t268 = t58*t237 + 576 | t268 = t58*t237 | ^ Warning: 't58' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3147:53: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:372:53: - 3147 | t5786, t5789, t579, t5792, t5795, t5797, t58, t5801, t5804, t5807, t5810, t5813, t5816, & + 372 | t5786, t5789, t579, t5792, t5795, t5797, t58, t5801, t5804, t5807, t5810, t5813, t5816, & | ^ note: 't58' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: - 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 | ^ Warning: 't579' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3147:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:372:27: - 3147 | t5786, t5789, t579, t5792, t5795, t5797, t58, t5801, t5804, t5807, t5810, t5813, t5816, & + 372 | t5786, t5789, t579, t5792, t5795, t5797, t58, t5801, t5804, t5807, t5810, t5813, t5816, & | ^ note: 't579' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4186:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1414:39: - 4186 | t2081*t575*t2082 + 1414 | t2081*t575*t2082 | ^ Warning: 't575' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3146:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:371:34: - 3146 | t5742, t5745, t5749, t575, t5752, t5756, t5760, t5767, t5770, t5773, t5776, t5780, t5783, & + 371 | t5742, t5745, t5749, t575, t5752, t5756, t5760, t5767, t5770, t5773, t5776, t5780, t5783, & | ^ note: 't575' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3619:69: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:847:69: - 3619 | *t170*t455*t17 + 0.3333333334e0_dp*t55*t57*t889 + 847 | *t170*t455*t17 + 0.3333333334e0_dp*t55*t57*t889 | ^ Warning: 't57' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3144:53: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:369:67: - 3144 | t569, t5692, t5695, t5696, t5698, t5699, t57, t5701, t5705 - | ^ + 369 | t5686, t5689, t569, t5692, t5695, t5696, t5698, t5699, t57, t5701, t5705 + | ^ note: 't57' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5481:36: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2709:36: - 5481 | t5011 + t5001 + 2709 | t5011 + t5001 | ^ Warning: 't569' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3144:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:369:27: - 3144 | t569, t5692, t5695, t5696, t5698, t5699, t57, t5701, t5705 - | ^ + 369 | t5686, t5689, t569, t5692, t5695, t5696, t5698, t5699, t57, t5701, t5705 + | ^ note: 't569' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4907:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2135:73: - 4907 | *t165*t166*t4729 + 0.3333333334e0_dp*t55*t57*t4782 + 2135 | *t165*t166*t4729 + 0.3333333334e0_dp*t55*t57*t4782 | ^ Warning: 't567' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3143:41: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:368:54: - 3143 | t5660, t5663, t5666, t5667, t567, t5670, t5671, t5673, t5676, t5679, t5682, t5686, t5689, & - | ^ + 368 | t5657, t566, t5660, t5663, t5666, t5667, t567, t5670, t5671, t5673, t5676, t5679, t5682, & + | ^ note: 't567' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4117:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1345:56: - 4117 | t1946 = 0.1666666667e0_dp*t165*t1392*t561 + 1345 | t1946 = 0.1666666667e0_dp*t165*t1392*t561 | ^ Warning: 't561' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3141:60: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:366:67: - 3141 | t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, t5622, & - | ^ + 366 | t5593, t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, & + | ^ note: 't561' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3445:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:673:30: - 3445 | t479 = t56*t140 + 673 | t479 = t56*t140 | ^ Warning: 't56' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3141:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:366:33: - 3141 | t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, t5622, & - | ^ + 366 | t5593, t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, & + | ^ note: 't56' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: - 5031 | *t105*t5118 + 2259 | *t105*t5118 | ^ Warning: 't558' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3140:68: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:365:75: - 3140 | t5564, t5565, t5568, t557, t5572, t5574, t5575, t5579, t558, t5581, t5585, t5590, t5593, & - | ^ + 365 | t5562, t5564, t5565, t5568, t557, t5572, t5574, t5575, t5579, t558, t5581, t5585, t5590, & + | ^ note: 't558' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5493:79: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2721:79: - 5493 | *t327*t2057*t557 - t5456 + t5459 - t5462 + t5466 - t5468 + 2721 | *t327*t2057*t557 - t5456 + t5459 - t5462 + t5466 - t5468 | ^ Warning: 't557' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3140:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:365:41: - 3140 | t5564, t5565, t5568, t557, t5572, t5574, t5575, t5579, t558, t5581, t5585, t5590, t5593, & - | ^ + 365 | t5562, t5564, t5565, t5568, t557, t5572, t5574, t5575, t5579, t558, t5581, t5585, t5590, & + | ^ note: 't557' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: - 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 | ^ Warning: 't550' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3138:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:363:32: - 3138 | REAL(kind=dp) :: t550, t5503, t5507, t5509, t551, t5511, t5516, t5523, t5525, t5528, t5531, & - | ^ + 363 | REAL(KIND=dp) :: t55, t550, t5503, t5507, t5509, t551, t5511, t5516, t5523, t5525, t5528, & + | ^ note: 't550' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5084:55: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2312:55: - 5084 | t5301 = 0.3333333336e0_dp*t55*t384*t4729 + 2312 | t5301 = 0.3333333336e0_dp*t55*t384*t4729 | ^ Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3137:75: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:363:26: - 3137 | t5480, t5482, t5484, t5487, t5489, t5492, t5494, t5496, t5499, t55 - | ^ + 363 | REAL(KIND=dp) :: t55, t550, t5503, t5507, t5509, t551, t5511, t5516, t5523, t5525, t5528, & + | ^ note: 't55' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3701:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:929:31: - 3701 | t1071 = t45*t541 + 929 | t1071 = t45*t541 | ^ Warning: 't541' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3134:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:359:90: - 3134 | t5376, t5379, t5383, t5386, t5389, t5397, t5400, t5402, t5406, t5409, t541, t5412, t5415, & - | ^ + 359 | t5373, t5376, t5379, t5383, t5386, t5389, t5397, t5400, t5402, t5406, t5409, t541, t5412, & + | ^ note: 't541' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: - 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: 't537' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3133:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:358:83: - 3133 | t5343, t5345, t5347, t5351, t5354, t5357, t5360, t5363, t5367, t537, t5370, t5371, t5373, & - | ^ + 358 | t5342, t5343, t5345, t5347, t5351, t5354, t5357, t5360, t5363, t5367, t537, t5370, t5371, & + | ^ note: 't537' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4450:69: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1678:69: - 4450 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 + 1678 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 | ^ Warning: 't534' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3132:90: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:357:97: - 3132 | t5314, t5317, t5320, t5323, t5326, t5329, t5330, t5333, t5335, t5338, t5339, t534, t5342, & - | ^ + 357 | t5311, t5314, t5317, t5320, t5323, t5326, t5329, t5330, t5333, t5335, t5338, t5339, t534, & + | ^ note: 't534' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4463:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1691:34: - 4463 | *t503*t2312 + 1691 | *t503*t2312 | ^ Warning: 't531' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3131:87: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:356:94: - 3131 | REAL(kind=dp) :: t5294, t5295, t5298, t53, t530, t5301, t5303, t5305, t5308, t531, t5311, & - | ^ + 356 | REAL(KIND=dp) :: t5291, t5294, t5295, t5298, t53, t530, t5301, t5303, t5305, t5308, t531, & + | ^ note: 't531' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4463:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1691:34: - 4463 | *t503*t2312 + 1691 | *t503*t2312 | ^ Warning: 't530' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3131:53: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:356:60: - 3131 | REAL(kind=dp) :: t5294, t5295, t5298, t53, t530, t5301, t5303, t5305, t5308, t531, t5311, & - | ^ + 356 | REAL(KIND=dp) :: t5291, t5294, t5295, t5298, t53, t530, t5301, t5303, t5305, t5308, t531, & + | ^ note: 't530' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4014:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1242:51: - 4014 | t1735 = 0.3703703705e-1_dp*t719*t527 + 1242 | t1735 = 0.3703703705e-1_dp*t719*t527 | ^ Warning: 't527' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3130:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:355:33: - 3130 | t526, t5262, t527, t5270, t5271, t5276, t5280, t5281, t5284, t5291 - | ^ + 355 | t5256, t526, t5262, t527, t5270, t5271, t5276, t5280, t5281, t5284 + | ^ note: 't527' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4472:64: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1700:64: - 4472 | *t2622*t71 - 0.1666666668e0_dp*t1106*t886 + 1700 | *t2622*t71 - 0.1666666668e0_dp*t1106*t886 | ^ Warning: 't526' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3130:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:355:20: - 3130 | t526, t5262, t527, t5270, t5271, t5276, t5280, t5281, t5284, t5291 - | ^ + 355 | t5256, t526, t5262, t527, t5270, t5271, t5276, t5280, t5281, t5284 + | ^ note: 't526' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: - 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: 't520' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3129:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:354:46: - 3129 | t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, t5256, & - | ^ + 354 | t516, t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, & + | ^ note: 't520' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: - 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: 't517' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3129:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:354:26: - 3129 | t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, t5256, & - | ^ + 354 | t516, t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, & + | ^ note: 't517' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: - 4726 | *t58*t3796*t71 + 1954 | *t58*t3796*t71 | ^ Warning: 't516' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3128:94: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:354:13: - 3128 | t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, t516, & - | ^ + 354 | t516, t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, & + | ^ note: 't516' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: - 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: 't515' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3128:88: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:353:95: - 3128 | t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, t516, & - | ^ + 353 | t5106, t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, & + | ^ note: 't515' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4463:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1691:34: - 4463 | *t503*t2312 + 1691 | *t503*t2312 | ^ Warning: 't512' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3128:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:353:47: - 3128 | t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, t516, & - | ^ + 353 | t5106, t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, & + | ^ note: 't512' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3756:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:984:32: - 3756 | t1213 = t511*t225 + 984 | t1213 = t511*t225 | ^ Warning: 't511' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3128:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:353:27: - 3128 | t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, t516, & - | ^ + 353 | t5106, t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, & + | ^ note: 't511' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5380:52: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2608:52: - 5380 | t6056 = 0.5555555558e-1_dp*t508*t5271 + 2608 | t6056 = 0.5555555558e-1_dp*t508*t5271 | ^ Warning: 't508' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3127:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:352:83: - 3127 | t5043, t5044, t5047, t5050, t5051, t5060, t5065, t5069, t5079, t508, t5083, t5087, t5106, & - | ^ + 352 | t5040, t5043, t5044, t5047, t5050, t5051, t5060, t5065, t5069, t5079, t508, t5083, t5087, & + | ^ note: 't508' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: - 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 + 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: 't503' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3126:69: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:351:76: - 3126 | t5011, t5013, t5016, t5019, t5022, t5025, t5028, t5029, t503, t5032, t5035, t5036, t5040, & - | ^ + 351 | t5009, t5011, t5013, t5016, t5019, t5022, t5025, t5028, t5029, t503, t5032, t5035, t5036, & + | ^ note: 't503' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3712:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:940:31: - 3712 | t1106 = t500*t67 + 940 | t1106 = t500*t67 | ^ Warning: 't500' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3125:58: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:350:65: - 3125 | t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, t5009, & - | ^ + 350 | t4952, t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, & + | ^ note: 't500' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4295:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1523:40: - 4295 | *t1368*t166*t2160 + 1523 | *t1368*t166*t2160 | ^ Warning: 't50' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3125:52: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:350:59: - 3125 | t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, t5009, & - | ^ + 350 | t4952, t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, & + | ^ note: 't50' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4450:69: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1678:69: - 4450 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 + 1678 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 | ^ Warning: 't498' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3125:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:350:40: - 3125 | t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, t5009, & - | ^ + 350 | t4952, t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, & + | ^ note: 't498' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: - 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: 't496' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3125:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:350:34: - 3125 | t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, t5009, & - | ^ + 350 | t4952, t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, & + | ^ note: 't496' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3341:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:569:30: - 3341 | t245*t17 + 569 | t245*t17 | ^ Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3122:67: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:347:74: - 3122 | t4884, t4887, t4889, t489, t4893, t4895, t4897, t4898, t49, t4901, t4904, t4905, t4907, & - | ^ + 347 | t4881, t4884, t4887, t4889, t489, t4893, t4895, t4897, t4898, t49, t4901, t4904, t4905, & + | ^ note: 't49' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: - 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 + 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 | ^ Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3122:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:347:41: - 3122 | t4884, t4887, t4889, t489, t4893, t4895, t4897, t4898, t49, t4901, t4904, t4905, t4907, & - | ^ + 347 | t4881, t4884, t4887, t4889, t489, t4893, t4895, t4897, t4898, t49, t4901, t4904, t4905, & + | ^ note: 't489' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3358:35: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:586:38: - 3358 | t289 = rho*t48*omega - | ^ + 586 | t289 = my_rho*t48*omega + | ^ Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3120:12: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:345:19: - 3120 | t48, t4800, t4801, t4804, t4808, t4812, t4817, t4820, t4829, t4830, t4833, t4834, t4837, & - | ^ + 345 | t4797, t48, t4800, t4801, t4804, t4808, t4812, t4817, t4820, t4829, t4830, t4833, t4834, & + | ^ note: 't48' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4430:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1658:33: - 4430 | t1176*t804 + 1658 | t1176*t804 | ^ Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3119:68: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:344:75: - 3119 | t4770, t4771, t4772, t4776, t478, t4782, t4786, t4789, t479, t4790, t4793, t4796, t4797, & - | ^ + 344 | t4769, t4770, t4771, t4772, t4776, t478, t4782, t4786, t4789, t479, t4790, t4793, t4796, & + | ^ note: 't479' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4946:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2174:39: - 4946 | t4895 = t478*t1500*t4729 + 2174 | t4895 = t478*t1500*t4729 | ^ Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3119:41: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:344:48: - 3119 | t4770, t4771, t4772, t4776, t478, t4782, t4786, t4789, t479, t4790, t4793, t4796, t4797, & - | ^ + 344 | t4769, t4770, t4771, t4772, t4776, t478, t4782, t4786, t4789, t479, t4790, t4793, t4796, & + | ^ note: 't478' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4430:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1658:33: - 4430 | t1176*t804 + 1658 | t1176*t804 | ^ Warning: 't474' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3118:48: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:343:55: - 3118 | t4733, t4734, t4736, t4738, t4739, t474, t4743, t4744, t4748, t4760, t4764, t4768, t4769, & - | ^ + 343 | t4732, t4733, t4734, t4736, t4738, t4739, t474, t4743, t4744, t4748, t4760, t4764, t4768, & + | ^ note: 't474' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5469:45: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2697:45: - 5469 | *t4901 - t4907 + t4911 + 2697 | *t4901 - t4907 + t4911 | ^ Warning: 't473' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3117:88: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:342:95: - 3117 | REAL(kind=dp) :: t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, t4732, & - | ^ + 342 | REAL(KIND=dp) :: t4708, t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, & + | ^ note: 't473' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4058:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1286:32: - 4058 | t1821 = t472*t262 + 1286 | t1821 = t472*t262 | ^ Warning: 't472' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3117:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:342:61: - 3117 | REAL(kind=dp) :: t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, t4732, & - | ^ + 342 | REAL(KIND=dp) :: t4708, t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, & + | ^ note: 't472' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5550:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2778:29: - 5550 | *t6271 + 2778 | *t6271 | ^ Warning: 't471' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3117:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:342:34: - 3117 | REAL(kind=dp) :: t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, t4732, & - | ^ + 342 | REAL(KIND=dp) :: t4708, t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, & + | ^ note: 't471' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3789:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1017:40: - 3789 | t1300 = 0.1e1_dp/t41/t470 + 1017 | t1300 = 0.1e1_dp/t41/t470 | ^ Warning: 't470' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3116:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:341:45: - 3116 | t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707, t4708 - | ^ + 341 | t4627, t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707 + | ^ note: 't470' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3415:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:643:30: - 3415 | t399 = t47*t398 + 643 | t399 = t47*t398 | ^ Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3116:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:341:39: - 3116 | t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707, t4708 - | ^ + 341 | t4627, t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707 + | ^ note: 't47' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4366:104: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1594:104: - 4366 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 + 1594 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 | ^ Warning: 't466' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3116:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:341:27: - 3116 | t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707, t4708 - | ^ + 341 | t4627, t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707 + | ^ note: 't466' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4381:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1609:40: - 4381 | *t2763*t446*t2779 + 1609 | *t2763*t446*t2779 | ^ Warning: 't462' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:85: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:97: - 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & - | ^ + 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & + | ^ note: 't462' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3485:108: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:713:98: - 3485 | t46*t541))*sx - | ^ + 713 | t46*t541))*sx + | ^ Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:72: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:84: - 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & - | ^ + 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & + | ^ note: 't46' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4295:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1523:40: - 4295 | *t1368*t166*t2160 + 1523 | *t1368*t166*t2160 | ^ Warning: 't455' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:46: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:58: - 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & - | ^ + 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & + | ^ note: 't455' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: - 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: 't451' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:38: - 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & - | ^ + 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & + | ^ note: 't451' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4366:104: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1594:104: - 4366 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 + 1594 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 | ^ Warning: 't450' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3115:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:25: - 3115 | t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, t4627, & - | ^ + 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & + | ^ note: 't450' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: - 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: 't446' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:77: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:84: - 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & - | ^ + 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & + | ^ note: 't446' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5415:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2643:38: - 5415 | t6144 = t445*t4512*t668 + 2643 | t6144 = t445*t4512*t668 | ^ Warning: 't445' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:71: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:78: - 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & - | ^ + 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & + | ^ note: 't445' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4369:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1597:33: - 4369 | t2763 = t1367*t444 + 1597 | t2763 = t1367*t444 | ^ Warning: 't444' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:65: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:72: - 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & - | ^ + 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & + | ^ note: 't444' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: - 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: 't437' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:40: - 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & - | ^ + 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & + | ^ note: 't437' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4418:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1646:57: - 4418 | - 0.5000000001e0_dp*t429*t437*t914 + 1646 | - 0.5000000001e0_dp*t429*t437*t914 | ^ Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3114:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:20: - 3114 | t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, t4498, t45, & - | ^ + 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & + | ^ note: 't433' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: - 4870 | t3869 + t4657 + t4696) + 2098 | t3869 + t4657 + t4696) | ^ Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:85: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:92: - 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & - | ^ + 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & + | ^ note: 't43' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5413:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2641:38: - 5413 | t6138 = t429*t1928*t593 + 2641 | t6138 = t429*t1928*t593 | ^ Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:80: - 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & - | ^ + 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & + | ^ note: 't429' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4520:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1748:30: - 4520 | t3305 = t4*t428 + 1748 | t3305 = t4*t428 | ^ Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:67: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:74: - 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & - | ^ + 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & + | ^ note: 't428' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5409:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2637:56: - 5409 | t6126 = 0.1800000000e2_dp*t658*t4764*t425 + 2637 | t6126 = 0.1800000000e2_dp*t658*t4764*t425 | ^ Warning: 't425' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:40: - 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & - | ^ + 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & + | ^ note: 't425' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4418:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1646:57: - 4418 | - 0.5000000001e0_dp*t429*t437*t914 + 1646 | - 0.5000000001e0_dp*t429*t437*t914 | ^ Warning: 't424' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3113:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:34: - 3113 | t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, t4317, & - | ^ + 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & + | ^ note: 't424' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3408:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:636:31: - 3408 | t383 = t42*omega + 636 | t383 = t42*omega | ^ Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:90: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:97: - 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & - | ^ + 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & + | ^ note: 't42' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4405:65: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1633:65: - 4405 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 + 1633 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 | ^ Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:85: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:92: - 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & - | ^ + 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & + | ^ note: 't417' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: - 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: 't413' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:65: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:72: - 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & - | ^ + 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & + | ^ note: 't413' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3562:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:790:38: - 3562 | t747 = lambda*t41*omega + 790 | t747 = lambda*t41*omega | ^ Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:45: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:52: - 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & - | ^ + 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & + | ^ note: 't41' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4405:65: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1633:65: - 4405 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 + 1633 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 | ^ Warning: 't406' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:33: - 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & - | ^ + 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & + | ^ note: 't406' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3591:35: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:819:35: - 3591 | *t49*t822*t14 + 819 | *t49*t822*t14 | ^ Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3112:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:27: - 3112 | t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, t4201, & - | ^ + 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & + | ^ note: 't405' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4393:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1621:39: - 4393 | *t400*t401*t2230 + 1621 | *t400*t401*t2230 | ^ Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:75: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:82: - 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & - | ^ + 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & + | ^ note: 't401' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5221:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2449:38: - 5221 | t5643 = t400*t3975*t561 + 2449 | t5643 = t400*t3975*t561 | ^ Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:69: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:76: - 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & - | ^ + 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & + | ^ note: 't400' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4420:41: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1648:41: - 4420 | t2992 = 0.1e1_dp/t1140/t40 + 1648 | t2992 = 0.1e1_dp/t1140/t40 | ^ Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:63: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:70: - 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & - | ^ + 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & + | ^ note: 't40' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3841:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1069:30: - 3841 | t1409 = t4*t164 + 1069 | t1409 = t4*t164 | ^ Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:58: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:65: - 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & - | ^ + 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & + | ^ note: 't4' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4099:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1327:32: - 4099 | t1912 = t399*t245 + 1327 | t1912 = t399*t245 | ^ Warning: 't399' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:61: - 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & - | ^ + 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & + | ^ note: 't399' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4498:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1726:34: - 4498 | t3278 = rho*t398 - | ^ + 1726 | t3278 = my_rho*t398 + | ^ Warning: 't398' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3111:41: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:48: - 3111 | t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, t4025, & - | ^ + 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & + | ^ note: 't398' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4366:104: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1594:104: - 4366 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 + 1594 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 | ^ Warning: 't394' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3110:88: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:335:94: - 3110 | REAL(kind=dp) :: t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, t3940, & - | ^ + 335 | REAL(KIND=dp) :: t387, t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, & + | ^ note: 't394' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4823:58: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2051:58: - 4823 | + 0.3333333334e0_dp*t165*t437*t1688 + 2051 | + 0.3333333334e0_dp*t165*t437*t1688 | ^ Warning: 't393' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3110:68: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:335:74: - 3110 | REAL(kind=dp) :: t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, t3940, & - | ^ + 335 | REAL(KIND=dp) :: t387, t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, & + | ^ note: 't393' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4418:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1646:57: - 4418 | - 0.5000000001e0_dp*t429*t437*t914 + 1646 | - 0.5000000001e0_dp*t429*t437*t914 | ^ Warning: 't392' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3110:55: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:335:61: - 3110 | REAL(kind=dp) :: t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, t3940, & - | ^ + 335 | REAL(KIND=dp) :: t387, t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, & + | ^ note: 't392' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3834:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1062:29: - 3834 | *t1397 + 1062 | *t1397 | ^ Warning: 't387' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3109:74: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:335:27: - 3109 | t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869, t387 - | ^ + 335 | REAL(KIND=dp) :: t387, t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, & + | ^ note: 't387' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4508:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1736:66: - 4508 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 + 1736 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 | ^ Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3109:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:334:33: - 3109 | t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869, t387 - | ^ + 334 | t3826, t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869 + | ^ note: 't384' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5099:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2327:51: - 5099 | t5335 = 0.2222222224e0_dp*t383*t5281 + 2327 | t5335 = 0.2222222224e0_dp*t383*t5281 | ^ Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3109:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:334:27: - 3109 | t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869, t387 - | ^ + 334 | t3826, t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869 + | ^ note: 't383' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3834:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1062:29: - 3834 | *t1397 + 1062 | *t1397 | ^ Warning: 't380' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:90: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:97: - 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & - | ^ + 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & + | ^ note: 't380' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4508:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1736:66: - 4508 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 + 1736 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 | ^ Warning: 't379' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:77: - 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & - | ^ + 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & + | ^ note: 't379' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5205:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2433:42: - 5205 | t5602 = 0.40e1_dp*t624*t376 + 2433 | t5602 = 0.40e1_dp*t624*t376 | ^ Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:64: - 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & - | ^ + 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & + | ^ note: 't376' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4340:55: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1568:55: - 4340 | 0.5866666667e2_dp*t962*t949*t375 + 1568 | 0.5866666667e2_dp*t962*t949*t375 | ^ Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:44: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:51: - 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & - | ^ + 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & + | ^ note: 't375' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3972:48: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1200:48: - 3972 | t1662 = 0.3200000000e2_dp*t7*t372 + 1200 | t1662 = 0.3200000000e2_dp*t7*t372 | ^ Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:38: - 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & - | ^ + 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & + | ^ note: 't372' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: - 4322 | *t2565*t796 + 1550 | *t2565*t796 | ^ Warning: 't371' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:18: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:25: - 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & - | ^ + 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & + | ^ note: 't371' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3490:61: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:718:61: - 3490 | t561 = 0.40e1_dp*t24*t37 - 0.20e1_dp*t102*t558 + 718 | t561 = 0.40e1_dp*t24*t37 - 0.20e1_dp*t102*t558 | ^ Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3108:12: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:19: - 3108 | t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, t3826, & - | ^ + 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & + | ^ note: 't37' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: - 4322 | *t2565*t796 + 1550 | *t2565*t796 | ^ Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:86: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:92: - 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & - | ^ + 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & + | ^ note: 't368' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3634:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:862:31: - 3634 | t942 = t367*t306 + 862 | t942 = t367*t306 | ^ Warning: 't367' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:52: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:58: - 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & - | ^ + 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & + | ^ note: 't367' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5164:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2392:38: - 5164 | t5496 = t366*t368*t1681 + 2392 | t5496 = t366*t368*t1681 | ^ Warning: 't366' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:45: - 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & - | ^ + 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & + | ^ note: 't366' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: - 4322 | *t2565*t796 + 1550 | *t2565*t796 | ^ Warning: 't365' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:39: - 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & - | ^ + 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & + | ^ note: 't365' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3973:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1201:42: - 3973 | t1664 = 0.60e1_dp*t550*t362 + 1201 | t1664 = 0.60e1_dp*t550*t362 | ^ Warning: 't362' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3107:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:33: - 3107 | t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, t3682, & - | ^ + 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & + | ^ note: 't362' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: - 4322 | *t2565*t796 + 1550 | *t2565*t796 | ^ Warning: 't360' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3106:93: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:13: - 3106 | t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, t360, & - | ^ + 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & + | ^ note: 't360' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3331:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:559:30: - 3331 | t221 = t220*t36 + 559 | t221 = t220*t36 | ^ Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3106:87: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:331:94: - 3106 | t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, t360, & - | ^ + 331 | t3546, t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, & + | ^ note: 't36' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: - 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 + 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 | ^ Warning: 't357' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3106:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:331:61: - 3106 | t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, t360, & - | ^ + 331 | t3546, t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, & + | ^ note: 't357' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3677:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:905:35: - 3677 | t1002*rho - | ^ + 905 | t1002*my_rho + | ^ Warning: 't356' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3106:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:331:41: - 3106 | t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, t360, & - | ^ + 331 | t3546, t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, & + | ^ note: 't356' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3969:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1197:51: - 3969 | t1656 = 0.8000000000e1_dp*t1429*t352 + 1197 | t1656 = 0.8000000000e1_dp*t1429*t352 | ^ Warning: 't352' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3105:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:330:73: - 3105 | t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, t3546, & - | ^ + 330 | t3497, t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, & + | ^ note: 't352' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: - 4622 | *t786*t1034*t1681 + 1850 | *t786*t1034*t1681 | ^ Warning: 't350' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3105:18: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:330:25: - 3105 | t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, t3546, & - | ^ + 330 | t3497, t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, & + | ^ note: 't350' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4331:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1559:40: - 4331 | t2585 = 0.1e1_dp/t972/t35 + 1559 | t2585 = 0.1e1_dp/t972/t35 | ^ Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3105:12: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:330:19: - 3105 | t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, t3546, & - | ^ + 330 | t3497, t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, & + | ^ note: 't35' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5159:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2387:51: - 5159 | t5484 = 0.1760000000e3_dp*t5460*t347 + 2387 | t5484 = 0.1760000000e3_dp*t5460*t347 | ^ Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:65: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:72: - 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & - | ^ + 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & + | ^ note: 't347' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3965:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1193:51: - 3965 | t1647 = 0.5600000000e2_dp*t1645*t343 + 1193 | t1647 = 0.5600000000e2_dp*t1645*t343 | ^ Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:45: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:52: - 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & - | ^ + 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & + | ^ note: 't343' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: - 4613 | + 0.3200000000e2_dp*t1055*t3674 + 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:46: - 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & - | ^ + 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & + | ^ note: 't342' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: - 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: 't341' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:40: - 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & - | ^ + 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & + | ^ note: 't341' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3104:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:34: - 3104 | t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, t3497, & - | ^ + 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & + | ^ note: 't339' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3960:49: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1188:49: - 3960 | t1638 = 0.1200000000e3_dp*t24*t336 + 1188 | t1638 = 0.1200000000e3_dp*t24*t336 | ^ Warning: 't336' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3103:69: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:328:76: - 3103 | REAL(kind=dp) :: t3344, t3347, t3352, t3353, t3356, t3357, t336, t3362, t3363, t3366, t3378, & - | ^ + 328 | REAL(KIND=dp) :: t3339, t3344, t3347, t3352, t3353, t3356, t3357, t336, t3362, t3363, t3366, & + | ^ note: 't336' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3974:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1202:79: - 3974 | t1667 = 0.28e2_dp/0.3e1_dp*t332 - 0.28e2_dp/0.3e1_dp*t987*rho - | ^ + 1202 | t1667 = 0.28e2_dp/0.3e1_dp*t332 - 0.28e2_dp/0.3e1_dp*t987*my_rho + | ^ Warning: 't332' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:67: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:80: - 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 - | ^ + 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 + | ^ note: 't332' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4519:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1747:63: - 4519 | e_rho_rho_rho_spin(ii) = e_rho_rho_rho_spin(ii) + t3291*sx - | ^ + 1747 | e_rho_rho_rho(ii) = e_rho_rho_rho(ii) + t3291*sx + | ^ Warning: 't3291' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:53: - 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 - | ^ + 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 + | ^ note: 't3291' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3944:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1172:42: - 3944 | t1615 = 0.80e1_dp*t112*t329 + 1172 | t1615 = 0.80e1_dp*t112*t329 | ^ Warning: 't329' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:46: - 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 - | ^ + 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 + | ^ note: 't329' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4340:55: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1568:55: - 4340 | 0.5866666667e2_dp*t962*t949*t375 + 1568 | 0.5866666667e2_dp*t962*t949*t375 | ^ Warning: 't328' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:33: - 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 - | ^ + 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 + | ^ note: 't328' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4653:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1881:32: - 4653 | t3842 = t3278*t46 + 1881 | t3842 = t3278*t46 | ^ Warning: 't3278' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3102:14: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:27: - 3102 | t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329, t3339 - | ^ + 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 + | ^ note: 't3278' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4330:85: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1558:85: - 4330 | - 0.20e1_dp*t102*t105*t2569 - 0.6400000001e2_dp*t321*t953*t979 + 1558 | - 0.20e1_dp*t102*t105*t2569 - 0.6400000001e2_dp*t321*t953*t979 | ^ Warning: 't327' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:92: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:20: - 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & - | ^ + 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 + | ^ note: 't327' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4704:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1932:32: - 4704 | t4025 = t3262*t57 + 1932 | t4025 = t3262*t57 | ^ Warning: 't3262' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:72: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:85: - 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & - | ^ + 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & + | ^ note: 't3262' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3933:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1161:34: - 3933 | t1598 = t326*rho - | ^ + 1161 | t1598 = t326*my_rho + | ^ Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:65: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:78: - 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & - | ^ + 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & + | ^ note: 't326' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4833:71: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2061:71: - 4833 | *t3507 - t3512)*t149*t160 + 2061 | *t3507 - t3512)*t149*t160 | ^ Warning: 't3248' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:59: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:72: - 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & - | ^ + 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & + | ^ note: 't3248' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: - 4806 | *t1246*t3244*t1483 + 2034 | *t1246*t3244*t1483 | ^ Warning: 't3244' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:52: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:65: - 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & - | ^ + 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & + | ^ note: 't3244' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5192:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2420:51: - 5192 | t5568 = 0.1066666667e2_dp*t1645*t322 + 2420 | t5568 = 0.1066666667e2_dp*t1645*t322 | ^ Warning: 't322' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:51: - 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & - | ^ + 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & + | ^ note: 't322' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5154:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2382:57: - 5154 | t5472 = 0.3200000001e2_dp*t321*t2455*t5079 + 2382 | t5472 = 0.3200000001e2_dp*t321*t2455*t5079 | ^ Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:45: - 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & - | ^ + 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & + | ^ note: 't321' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3931:43: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1159:43: - 3931 | t1596 = 0.320e2_dp*t605*t318 + 1159 | t1596 = 0.320e2_dp*t605*t318 | ^ Warning: 't318' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:19: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:32: - 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & - | ^ + 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & + | ^ note: 't318' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4340:55: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1568:55: - 4340 | 0.5866666667e2_dp*t962*t949*t375 + 1568 | 0.5866666667e2_dp*t962*t949*t375 | ^ Warning: 't317' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3101:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:26: - 3101 | t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, t3268, t327, & - | ^ + 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & + | ^ note: 't317' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4340:55: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1568:55: - 4340 | 0.5866666667e2_dp*t962*t949*t375 + 1568 | 0.5866666667e2_dp*t962*t949*t375 | ^ Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:97: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:20: - 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & - | ^ + 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & + | ^ note: 't316' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5149:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2377:51: - 5149 | t5462 = 0.1173333333e3_dp*t5460*t313 + 2377 | t5462 = 0.1173333333e3_dp*t5460*t313 | ^ Warning: 't313' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:84: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:91: - 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & - | ^ + 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & + | ^ note: 't313' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: - 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: 't311' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:71: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:78: - 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & - | ^ + 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & + | ^ note: 't311' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3487:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:715:29: - 3487 | t551 = t27*t31 + 715 | t551 = t27*t31 | ^ Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:65: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:72: - 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & - | ^ + 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & + | ^ note: 't31' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: - 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 + 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 | ^ Warning: 't3097' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:53: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:60: - 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & - | ^ + 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & + | ^ note: 't3097' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3662:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:890:40: - 3662 | t1002 = 0.1e1_dp/t19/t309 + 890 | t1002 = 0.1e1_dp/t19/t309 | ^ Warning: 't309' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:46: - 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & - | ^ + 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & + | ^ note: 't309' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3672:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:900:31: - 3672 | t1033 = t308*t12 + 900 | t1033 = t308*t12 | ^ Warning: 't308' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:33: - 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & - | ^ + 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & + | ^ note: 't308' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5207:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2435:56: - 5207 | t5607 = 0.5866666667e2_dp*t307*t949*t5069 + 2435 | t5607 = 0.5866666667e2_dp*t307*t949*t5069 | ^ Warning: 't307' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3100:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:20: - 3100 | t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, t3141, t316, & - | ^ + 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & + | ^ note: 't307' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3630:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:858:31: - 3630 | t929 = t306*t311 + 858 | t929 = t306*t311 | ^ Warning: 't306' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:85: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:92: - 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & - | ^ + 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & + | ^ note: 't306' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: - 4737 | *t478*t183*t3918 + 1965 | *t478*t183*t3918 | ^ Warning: 't3030' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:79: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:86: - 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & - | ^ + 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & + | ^ note: 't3030' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 | ^ Warning: 't302' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:65: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:72: - 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & - | ^ + 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & + | ^ note: 't302' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: - 4737 | *t478*t183*t3918 + 1965 | *t478*t183*t3918 | ^ Warning: 't2998' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:59: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:66: - 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & - | ^ + 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & + | ^ note: 't2998' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: - 4737 | *t478*t183*t3918 + 1965 | *t478*t183*t3918 | ^ Warning: 't2994' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:52: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:59: - 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & - | ^ + 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & + | ^ note: 't2994' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5550:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2778:29: - 5550 | *t6271 + 2778 | *t6271 | ^ Warning: 't2992' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:45: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:52: - 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & - | ^ + 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & + | ^ note: 't2992' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3921:49: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1149:49: - 3921 | t1579 = 0.1173333333e3_dp*t24*t299 + 1149 | t1579 = 0.1173333333e3_dp*t24*t299 | ^ Warning: 't299' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:45: - 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & - | ^ + 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & + | ^ note: 't299' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3932:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1160:30: - 3932 | t1597 = t7*t298 + 1160 | t1597 = t7*t298 | ^ Warning: 't298' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:39: - 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & - | ^ + 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & + | ^ note: 't298' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3834:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1062:29: - 3834 | *t1397 + 1062 | *t1397 | ^ Warning: 't295' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:33: - 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & - | ^ + 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & + | ^ note: 't295' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: - 4516 | + t3288) + 1744 | + t3288) | ^ Warning: 't294' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:27: - 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & - | ^ + 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & + | ^ note: 't294' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4823:58: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2051:58: - 4823 | + 0.3333333334e0_dp*t165*t437*t1688 + 2051 | + 0.3333333334e0_dp*t165*t437*t1688 | ^ Warning: 't2937' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3099:14: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:21: - 3099 | t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, t3069, & - | ^ + 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & + | ^ note: 't2937' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4508:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1736:66: - 4508 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 + 1736 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 | ^ Warning: 't290' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:88: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:94: - 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & - | ^ + 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & + | ^ note: 't290' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5428:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2656:38: - 5428 | t6181 = t289*t1564*t593 + 2656 | t6181 = t289*t1564*t593 | ^ Warning: 't289' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:82: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:88: - 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & - | ^ + 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & + | ^ note: 't289' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5115:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2343:39: - 5115 | t5373 = t2885*t446*t5371 + 2343 | t5373 = t2885*t446*t5371 | ^ Warning: 't2885' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:82: - 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & - | ^ + 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & + | ^ note: 't2885' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: - 4695 | t1320*t1483 + 1923 | t1320*t1483 | ^ Warning: 't2873' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:62: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:68: - 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & - | ^ + 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & + | ^ note: 't2873' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3838:106: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1066:96: - 3838 | t804 - 0.4444444448e0_dp*t43*t894 + t8*t1401)*sx - | ^ + 1066 | t804 - 0.4444444448e0_dp*t43*t894 + t8*t1401)*sx + | ^ Warning: 't283' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:33: - 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & - | ^ + 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & + | ^ note: 't283' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4682:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1910:40: - 4682 | *t400*t1333*t1410 + 1910 | *t400*t1333*t1410 | ^ Warning: 't2823' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:21: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:27: - 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & - | ^ + 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & + | ^ note: 't2823' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5481:36: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2709:36: - 5481 | t5011 + t5001 + 2709 | t5011 + t5001 | ^ Warning: 't2821' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3098:14: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:20: - 3098 | t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, t2935, & - | ^ + 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & + | ^ note: 't2821' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: - 4516 | + t3288) + 1744 | + t3288) | ^ Warning: 't282' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:94: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:13: - 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & - | ^ + 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & + | ^ note: 't282' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4682:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1910:40: - 4682 | *t400*t1333*t1410 + 1910 | *t400*t1333*t1410 | ^ Warning: 't2808' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:81: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:87: - 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & - | ^ + 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & + | ^ note: 't2808' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: - 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 | ^ Warning: 't278' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:67: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:73: - 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & - | ^ + 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & + | ^ note: 't278' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5118:59: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2346:59: - 5118 | t5383 = 0.4166666667e-1_dp*t2763*t1247*t5002 + 2346 | t5383 = 0.4166666667e-1_dp*t2763*t1247*t5002 | ^ Warning: 't2763' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:60: - 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & - | ^ + 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & + | ^ note: 't2763' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4463:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1691:34: - 4463 | *t503*t2312 + 1691 | *t503*t2312 | ^ Warning: 't275' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:46: - 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & - | ^ + 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & + | ^ note: 't275' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4580:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1808:33: - 4580 | t3569 = t274*t1505 + 1808 | t3569 = t274*t1505 | ^ Warning: 't274' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:40: - 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & - | ^ + 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & + | ^ note: 't274' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: - 4806 | *t1246*t3244*t1483 + 2034 | *t1246*t3244*t1483 | ^ Warning: 't2720' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3097:14: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:20: - 3097 | t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, t282, & - | ^ + 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & + | ^ note: 't2720' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4450:69: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1678:69: - 4450 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 + 1678 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 | ^ Warning: 't271' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:91: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:13: - 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & - | ^ + 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & + | ^ note: 't271' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: - 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 + 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 | ^ Warning: 't2707' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:85: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:92: - 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & - | ^ + 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & + | ^ note: 't2707' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3487:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:715:29: - 3487 | t551 = t27*t31 + 715 | t551 = t27*t31 | ^ Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:78: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:85: - 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & - | ^ + 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & + | ^ note: 't27' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: - 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: 't268' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:80: - 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & - | ^ + 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & + | ^ note: 't268' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4482:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: - 4482 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 + 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 | ^ Warning: 't267' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:67: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:74: - 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & - | ^ + 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & + | ^ note: 't267' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4450:69: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1678:69: - 4450 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 + 1678 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 | ^ Warning: 't266' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:61: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:68: - 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & - | ^ + 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & + | ^ note: 't266' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: - 4851 | *t289*t294*t1553 + 2079 | *t289*t294*t1553 | ^ Warning: 't2636' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3096:35: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:42: - 3096 | REAL(kind=dp) :: t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, t271, & - | ^ + 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & + | ^ note: 't2636' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: - 4859 | *t83*t45*t3581*t140 + 2087 | *t83*t45*t3581*t140 | ^ Warning: 't2631' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:80: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:28: - 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 - | ^ + 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & + | ^ note: 't2631' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4058:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1286:32: - 4058 | t1821 = t472*t262 + 1286 | t1821 = t472*t262 | ^ Warning: 't262' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:59: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:66: - 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 - | ^ + 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 + | ^ note: 't262' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5143:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2371:57: - 5143 | t5449 = 0.1173333333e3_dp*t307*t2611*t5065 + 2371 | t5449 = 0.1173333333e3_dp*t307*t2611*t5065 | ^ Warning: 't2611' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:53: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:60: - 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 - | ^ + 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 + | ^ note: 't2611' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5248:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2476:73: - 5248 | t5716 = 0.1620000000e3_dp*t4994*t392*t4769*t1141*t26*t5713 + 2476 | t5716 = 0.1620000000e3_dp*t4994*t392*t4769*t1141*t26*t5713 | ^ Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:47: - 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 - | ^ + 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 + | ^ note: 't26' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4630:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1858:33: - 4630 | t3750 = t2585*t136 + 1858 | t3750 = t2585*t136 | ^ Warning: 't2585' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:35: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:42: - 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 - | ^ + 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 + | ^ note: 't2585' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5172:67: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2400:67: - 5172 | *t5511 + 0.1200000000e3_dp*t1055*t2565*t4721 + 2400 | *t5511 + 0.1200000000e3_dp*t1055*t2565*t4721 | ^ Warning: 't2565' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3095:14: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:21: - 3095 | t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622, t2631 - | ^ + 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 + | ^ note: 't2565' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4604:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1832:32: - 4604 | t3668 = t2552*t23 + 1832 | t3668 = t2552*t23 | ^ Warning: 't2552' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:93: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:14: - 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & - | ^ + 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 + | ^ note: 't2552' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: - 4613 | + 0.3200000000e2_dp*t1055*t3674 + 1841 | + 0.3200000000e2_dp*t1055*t3674 | ^ Warning: 't2537' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:86: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:93: - 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & - | ^ + 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & + | ^ note: 't2537' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: - 5005 | + t5032 + t5035 + 2233 | + t5032 + t5035 | ^ Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:79: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:86: - 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & - | ^ + 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & + | ^ note: 't250' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3479:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:707:26: - 3479 | t537 + 707 | t537 | ^ Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:80: - 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & - | ^ + 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & + | ^ note: 't25' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4927:59: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2155:59: + + 2155 | - 0.2400000000e2_dp*t786/t2492*t1058 + | ^ +Warning: 't2492' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:75: + + 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & + | ^ +note: 't2492' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1523:40: + + 1523 | *t1368*t166*t2160 + | ^ +Warning: 't249' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:68: + + 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & + | ^ +note: 't249' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: + + 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + | ^ +Warning: 't2480' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:62: + + 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & + | ^ +note: 't2480' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: + + 1857 | *t321*t953*t1625 + | ^ +Warning: 't2468' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:55: + + 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & + | ^ +note: 't2468' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2382:57: + + 2382 | t5472 = 0.3200000001e2_dp*t321*t2455*t5079 + | ^ +Warning: 't2455' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:48: + + 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & + | ^ +note: 't2455' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1327:32: + + 1327 | t1912 = t399*t245 + | ^ +Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:34: + + 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & + | ^ +note: 't245' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: + + 2079 | *t289*t294*t1553 + | ^ +Warning: 't2404' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:86: + + 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & + | ^ +note: 't2404' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:615:30: + + 615 | t350 = t24*t225 + | ^ +Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:79: + + 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & + | ^ +note: 't24' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: + + 1744 | + t3288) + | ^ +Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:53: + + 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & + | ^ +note: 't237' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1152:44: + + 1152 | t1584 = 0.320e2_dp*t1582*t234 + | ^ +Warning: 't234' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:33: + + 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & + | ^ +note: 't234' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1558:85: + + 1558 | - 0.20e1_dp*t102*t105*t2569 - 0.6400000001e2_dp*t321*t953*t979 + | ^ +Warning: 't233' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:27: + + 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & + | ^ +note: 't233' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1083:53: + + 1083 | + 0.8000000000e1_dp*t366*t1440 + | ^ +Warning: 't230' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:317:53: + + 317 | t2287, t2292, t2295, t2296, t2299, t23, t230, t2300, t2304, t2307, t2308, t2311, t2312, & + | ^ +note: 't230' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1173:29: + + 1173 | t1616 = t7*t23 + | ^ +Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:317:47: + + 317 | t2287, t2292, t2295, t2296, t2299, t23, t230, t2300, t2304, t2307, t2308, t2311, t2312, & + | ^ +note: 't23' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1650:31: + + 1650 | t2998 = t27*t225 + | ^ +Warning: 't225' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:92: + + 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & + | ^ +note: 't225' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:887:40: + + 887 | t995 = 0.1e1_dp/t787/t224 + | ^ +Warning: 't224' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:86: + + 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & + | ^ +note: 't224' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: + + 1850 | *t786*t1034*t1681 + | ^ +Warning: 't2220' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:59: + + 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & + | ^ +note: 't2220' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1087:28: + + 1087 | t1444 + | ^ +Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:52: + + 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & + | ^ +note: 't221' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: + + 1550 | *t2565*t796 + | ^ +Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:18: + + 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & + | ^ +note: 't220' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:605:30: + + 605 | t327 = t22*t326 + | ^ +Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:12: + + 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & + | ^ +note: 't22' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:885:31: + + 885 | t987 = t219*t341 + | ^ +Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:314:67: + + 314 | REAL(KIND=dp) :: t2169, t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, & + | ^ +note: 't219' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: + + 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + | ^ +Warning: 't2182' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:314:47: + + 314 | REAL(KIND=dp) :: t2169, t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, & + | ^ +note: 't2182' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: + + 1550 | *t2565*t796 + | ^ +Warning: 't218' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:314:40: + + 314 | REAL(KIND=dp) :: t2169, t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, & + | ^ +note: 't218' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2164:42: + + 2164 | t4864 = t217*t46*t1535*t561 + | ^ +Warning: 't217' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:314:34: + + 314 | REAL(KIND=dp) :: t2169, t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, & + | ^ +note: 't217' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2101:56: + + 2101 | t4704 = 0.3333333336e0_dp*t2147*t84*t4701 + | ^ +Warning: 't2147' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:62: + + 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 + | ^ +note: 't2147' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2136:55: + + 2136 | t4789 = 0.4444444448e0_dp*t214*t46*t4786 + | ^ +Warning: 't214' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:48: + + 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 + | ^ +note: 't214' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2738:79: + + 2738 | *t6181 - t6185 + t6189 - t6192 - 0.3333333336e0_dp*t6194 + | ^ +Warning: 't2139' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:42: + + 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 + | ^ +note: 't2139' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2753:90: + + 2753 | t5418 + 0.1800000000e2_dp*t658*t575*t2074 + 0.1800000000e2_dp*t5421 + | ^ +Warning: 't2131' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:28: + + 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 + | ^ +note: 't2131' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2790:82: + + 2790 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 + | ^ +Warning: 't2126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:14: + + 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 + | ^ +note: 't2126' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2810:46: + + 2810 | *t60*t2124*t709 - t6044 + | ^ +Warning: 't2124' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:91: + + 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & + | ^ +note: 't2124' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2790:82: + + 2790 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 + | ^ +Warning: 't2118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:84: + + 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & + | ^ +note: 't2118' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2794:41: + + 2794 | *t5228*t2117*t2028 + | ^ +Warning: 't2117' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:77: + + 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & + | ^ +note: 't2117' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2790:82: + + 2790 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 + | ^ +Warning: 't2114' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:70: + + 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & + | ^ +note: 't2114' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2810:46: + + 2810 | *t60*t2124*t709 - t6044 + | ^ +Warning: 't2113' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:63: + + 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & + | ^ +note: 't2113' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2800:60: + + 2800 | t6260 + 0.8999999998e1_dp*t5229*t2104 + | ^ +Warning: 't2104' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:49: + + 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & + | ^ +note: 't2104' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2778:29: + + 2778 | *t6271 + | ^ +Warning: 't2099' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:42: + + 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & + | ^ +note: 't2099' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2794:41: + + 2794 | *t5228*t2117*t2028 + | ^ +Warning: 't2098' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:35: + + 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & + | ^ +note: 't2098' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2790:82: + + 2790 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 + | ^ +Warning: 't2095' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:28: + + 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & + | ^ +note: 't2095' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: + + 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) + | ^ +Warning: 't2088' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:21: + + 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & + | ^ +note: 't2088' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: + + 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) + | ^ +Warning: 't2082' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:97: + + 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & + | ^ +note: 't2082' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2768:38: + + 2768 | - t6090 + t6094 + | ^ +Warning: 't2081' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:90: + + 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & + | ^ +note: 't2081' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: + + 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) + | ^ +Warning: 't2077' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:83: + + 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & + | ^ +note: 't2077' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2753:90: + + 2753 | t5418 + 0.1800000000e2_dp*t658*t575*t2074 + 0.1800000000e2_dp*t5421 + | ^ +Warning: 't2074' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:76: + + 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & + | ^ +note: 't2074' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: + + 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 + | ^ +Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:62: + + 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & + | ^ +note: 't207' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2739:33: + + 2739 | t6400 = t2061*t561 + | ^ +Warning: 't2061' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:56: + + 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & + | ^ +note: 't2061' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2731:78: + + 2731 | - t5595 + t5597 - t5600 - t5602 + t5604 + t5607 + t5610 + | ^ +Warning: 't2058' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:49: + + 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & + | ^ +note: 't2058' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2721:79: + + 2721 | *t327*t2057*t557 - t5456 + t5459 - t5462 + t5466 - t5468 + | ^ +Warning: 't2057' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:42: + + 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & + | ^ +note: 't2057' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2725:40: + + 2725 | *t1054*t640*t3679 + | ^ +Warning: 't2054' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:35: + + 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & + | ^ +note: 't2054' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2825:132: + + 2825 | + t6442 + t6451 + t6461 + t6479 + t6490 + t6499 + t6658) + | ^ +Warning: 't2050' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:28: + + 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & + | ^ +note: 't2050' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2829:73: + + 2829 | t43*t46*t6339 + t8*(t6344 + t6380 + t6389 + t6665) + | ^ +Warning: 't2046' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:21: + + 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & + | ^ +note: 't2046' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2764:63: + + 2764 | *t575*t161*t1447 + t5773 + t5776 + t5780 + | ^ +Warning: 't2042' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:14: + + 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & + | ^ +note: 't2042' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: + + 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) + | ^ +Warning: 't2035' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:97: + + 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + | ^ +note: 't2035' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2810:46: + + 2810 | *t60*t2124*t709 - t6044 + | ^ +Warning: 't2032' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:90: + + 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + | ^ +note: 't2032' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2743:46: + + 2743 | *t27*t6291*t172 - t5397 + | ^ +Warning: 't2031' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:83: + + 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + | ^ +note: 't2031' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:666:30: + + 666 | t466 = t27*t203 + | ^ +Warning: 't203' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:76: + + 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + | ^ +note: 't203' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2794:41: + + 2794 | *t5228*t2117*t2028 + | ^ +Warning: 't2028' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:70: + + 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + | ^ +note: 't2028' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2778:29: + + 2778 | *t6271 + | ^ +Warning: 't2027' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:63: + + 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + | ^ +note: 't2027' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: + + 2233 | + t5032 + t5035 + | ^ +Warning: 't2022' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:56: + + 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + | ^ +note: 't2022' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: + + 2716 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't2018' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:49: + + 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + | ^ +note: 't2018' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: + + 2716 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't2014' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:42: + + 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + | ^ +note: 't2014' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: + + 2716 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't2013' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:35: + + 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + | ^ +note: 't2013' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: + + 2716 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't2009' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:28: + + 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + | ^ +note: 't2009' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1895:32: + + 1895 | t3875 = t45*t2002 + | ^ +Warning: 't2002' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:14: + + 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + | ^ +note: 't2002' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:777:87: + + 777 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 + | ^ +Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:80: + + 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & + | ^ +note: 't200' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1355:31: + + 1355 | t1972 = t177*t20 + | ^ +Warning: 't20' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:74: + + 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & + | ^ +note: 't20' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:693:31: + + 693 | t534 = t199*t267 + | ^ +Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:48: + + 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & + | ^ +note: 't199' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2478:56: + + 2478 | t5722 = 0.1111111111e0_dp*t165*t689*t1988 + | ^ +Warning: 't1988' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:42: + + 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & + | ^ +note: 't1988' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2026:66: + + 2026 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 + | ^ +Warning: 't1981' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:21: + + 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & + | ^ +note: 't1981' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2357:43: + + 2357 | t5421 = t657*t1884*t59*t1975 + | ^ +Warning: 't1975' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:90: + + 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & + | ^ +note: 't1975' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2756:70: + + 2756 | + t5619 + t5622 - t5625 - t5628 + t5631 + t5716 + | ^ +Warning: 't1974' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:83: + + 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & + | ^ +note: 't1974' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: + + 2716 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't1973' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:76: + + 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & + | ^ +note: 't1973' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2631:63: + + 2631 | t6106 = 0.3600000000e2_dp*t1971*t1972*t1973*t672 + | ^ +Warning: 't1972' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:69: + + 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & + | ^ +note: 't1972' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2631:63: + + 2631 | t6106 = 0.3600000000e2_dp*t1971*t1972*t1973*t672 + | ^ +Warning: 't1971' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:62: + + 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & + | ^ +note: 't1971' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2621:57: + + 2621 | t6087 = 0.1666666667e0_dp*t429*t1966*t1410 + | ^ +Warning: 't1966' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:48: + + 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & + | ^ +note: 't1966' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2305:68: + + 2305 | *t462*t4729 + 0.3333333334e0_dp*t55*t57*t5276 + | ^ +Warning: 't1962' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:34: + + 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & + | ^ +note: 't1962' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:777:87: + + 777 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 + | ^ +Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:20: + + 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & + | ^ +note: 't196' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:688:30: + + 688 | t520 = t195*t25 + | ^ +Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:82: + + 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & + | ^ +note: 't195' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2042:44: + + 2042 | + (2*t147*t1284*t672) + | ^ +Warning: 't1940' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:62: + + 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & + | ^ +note: 't1940' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:690:36: + + 690 | t527 = t194*t187*t526 + | ^ +Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:55: + + 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & + | ^ +note: 't194' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: + + 2034 | *t1246*t3244*t1483 + | ^ +Warning: 't1932' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:35: + + 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & + | ^ +note: 't1932' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2641:38: + + 2641 | t6138 = t429*t1928*t593 + | ^ +Warning: 't1928' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:28: + + 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & + | ^ +note: 't1928' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2642:38: + + 2642 | t6141 = t658*t575*t1925 + | ^ +Warning: 't1925' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:306:62: + + 306 | t1912, t1914, t1917, t192, t1920, t1923, t1924, t1925 + | ^ +note: 't1925' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2051:58: + + 2051 | + 0.3333333334e0_dp*t165*t437*t1688 + | ^ +Warning: 't1924' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:306:55: + + 306 | t1912, t1914, t1917, t192, t1920, t1923, t1924, t1925 + | ^ +note: 't1924' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2556:38: + + 2556 | t5938 = t192*t728*t1505 + | ^ +Warning: 't192' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:306:34: + + 306 | t1912, t1914, t1917, t192, t1920, t1923, t1924, t1925 + | ^ +note: 't192' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: + + 1923 | t1320*t1483 + | ^ +Warning: 't1912' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:306:14: + + 306 | t1912, t1914, t1917, t192, t1920, t1923, t1924, t1925 + | ^ +note: 't1912' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: + + 1923 | t1320*t1483 + | ^ +Warning: 't1902' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:81: + + 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & + | ^ +note: 't1902' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: + + 2716 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:67: + + 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & + | ^ +note: 't19' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2456:58: + + 2456 | t5666 = 0.1125000000e2_dp*t1302*t1892*t1410 + | ^ +Warning: 't1892' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:48: + + 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & + | ^ +note: 't1892' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:681:30: + + 681 | t503 = t189*t67 + | ^ +Warning: 't189' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:34: + + 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & + | ^ +note: 't189' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2042:44: + + 2042 | + (2*t147*t1284*t672) + | ^ +Warning: 't1886' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:28: + + 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & + | ^ +note: 't1886' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2709:36: + + 2709 | t5011 + t5001 + | ^ +Warning: 't1885' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:21: + + 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & + | ^ +note: 't1885' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2357:43: + + 2357 | t5421 = t657*t1884*t59*t1975 + | ^ +Warning: 't1884' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:14: + + 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & + | ^ +note: 't1884' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: + + 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 + | ^ +Warning: 't1875' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:304:83: + + 304 | t1852, t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, & + | ^ +note: 't1875' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:762:30: + + 762 | t707 = t187*t59 + | ^ +Warning: 't187' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:304:62: + + 304 | t1852, t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, & + | ^ +note: 't187' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2632:58: + + 2632 | t6109 = 0.1666666667e0_dp*t1246*t1962*t1865 + | ^ +Warning: 't1865' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:304:49: + + 304 | t1852, t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, & + | ^ +note: 't1865' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2035:32: + + 2035 | t4498 = t56*t1843 + | ^ +Warning: 't1843' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:90: + + 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & + | ^ +note: 't1843' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2585:33: + + 2585 | t6006 = t719*t1838 + | ^ +Warning: 't1838' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:76: + + 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & + | ^ +note: 't1838' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1947:70: + + 1947 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 + | ^ +Warning: 't1837' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:69: + + 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & + | ^ +note: 't1837' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2542:42: + + 2542 | t5908 = t1836*t59*t177*t710 + | ^ +Warning: 't1836' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:62: + + 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & + | ^ +note: 't1836' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: + + 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 + | ^ +Warning: 't183' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:41: + + 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & + | ^ +note: 't183' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2504:40: + + 2504 | t5797 = t1373*t1962*t1829 + | ^ +Warning: 't1829' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:35: + + 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & + | ^ +note: 't1829' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2350:57: + + 2350 | t5400 = 0.3333333334e0_dp*t445*t1962*t1825 + | ^ +Warning: 't1825' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:21: + + 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & + | ^ +note: 't1825' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1975:29: + + 1975 | *t3382 + | ^ +Warning: 't1821' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:88: + + 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & + | ^ +note: 't1821' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: + + 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 + | ^ +Warning: 't182' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:81: + + 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & + | ^ +note: 't182' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: + + 1965 | *t478*t183*t3918 + | ^ +Warning: 't1811' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:61: + + 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & + | ^ +note: 't1811' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2508:58: + + 2508 | t5810 = 0.1080000000e3_dp*t1143*t1801*t1410 + | ^ +Warning: 't1801' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:33: + + 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & + | ^ +note: 't1801' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2709:36: + + 2709 | t5011 + t5001 + | ^ +Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:19: + + 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & + | ^ +note: 't18' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2560:52: + + 2560 | t5949 = 0.8999999998e1_dp*t1795*t4909 + | ^ +Warning: 't1795' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:97: + + 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & + | ^ +note: 't1795' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2568:34: + + 2568 | t5966 = t1785*t1790 + | ^ +Warning: 't1790' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:83: + + 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & + | ^ +note: 't1790' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2568:34: + + 2568 | t5966 = t1785*t1790 + | ^ +Warning: 't1785' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:62: + + 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & + | ^ +note: 't1785' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2615:51: + + 2615 | t6078 = 0.1111111112e0_dp*t719*t1782 + | ^ +Warning: 't1782' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:48: + + 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & + | ^ +note: 't1782' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2584:38: + + 2584 | t6004 = t1709*t178*t710 + | ^ +Warning: 't178' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:41: + + 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & + | ^ +note: 't178' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2586:52: + + 2586 | t6009 = 0.5000000001e0_dp*t1777*t4908 + | ^ +Warning: 't1777' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:28: + + 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & + | ^ +note: 't1777' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2578:52: + + 2578 | t5985 = 0.5000000001e0_dp*t1774*t4908 + | ^ +Warning: 't1774' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:14: + + 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & + | ^ +note: 't1774' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:763:31: + + 763 | t708 = t707*t177 + | ^ +Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:89: + + 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & + | ^ +note: 't177' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2536:33: + + 2536 | t5885 = t719*t1769 + | ^ +Warning: 't1769' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:83: + + 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & + | ^ +note: 't1769' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2610:40: + + 2610 | t6060 = t1766*t5881*t4940 + | ^ +Warning: 't1766' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:69: + + 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & + | ^ +note: 't1766' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2603:52: + + 2603 | t6044 = 0.2000000002e1_dp*t1763*t5956 + | ^ +Warning: 't1763' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:55: + + 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & + | ^ +note: 't1763' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:950:30: + + 950 | t1140 = t176**2 + | ^ +Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:34: + + 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & + | ^ +note: 't176' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: + + 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 + | ^ +Warning: 't1755' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:70: + + 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 + | ^ +note: 't1755' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2597:72: + + 2597 | *t6021 + t6025 - 0.5555555558e-1_dp*t58*t5613*t71 + | ^ +Warning: 't1748' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:49: + + 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 + | ^ +note: 't1748' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: + + 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + | ^ +Warning: 't1745' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:42: + + 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 + | ^ +note: 't1745' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2562:52: + + 2562 | t5954 = 0.8999999998e1_dp*t1741*t4909 + | ^ +Warning: 't1741' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:28: + + 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 + | ^ +note: 't1741' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2554:57: + + 2554 | t5929 = 0.2250000000e2_dp*t1740*t471*t4905 + | ^ +Warning: 't1740' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:21: + + 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 + | ^ +note: 't1740' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: + + 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 + | ^ +Warning: 't1737' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:14: + + 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 + | ^ +note: 't1737' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2003:32: + + 2003 | t4352 = t1731*t67 + | ^ +Warning: 't1731' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:90: + + 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & + | ^ +note: 't1731' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2588:52: + + 2588 | t6019 = 0.7407407410e-1_dp*t719*t1726 + | ^ +Warning: 't1726' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:69: + + 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & + | ^ +note: 't1726' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2620:37: + + 2620 | *t6075 - t6078 + | ^ +Warning: 't1722' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:55: + + 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & + | ^ +note: 't1722' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2611:52: + + 2611 | t6063 = 0.1000000000e1_dp*t1720*t5956 + | ^ +Warning: 't1720' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:48: + + 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & + | ^ +note: 't1720' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:782:70: + + 782 | *t165*t462*t561 + 0.3333333334e0_dp*t55*t57*t735 + | ^ +Warning: 't172' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:41: + + 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & + | ^ +note: 't172' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2540:56: + + 2540 | t5902 = 0.1800000000e2_dp*t1718*t178*t710 + | ^ +Warning: 't1718' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:28: + + 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & + | ^ +note: 't1718' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2567:34: + + 2567 | t5964 = t1715*t1525 + | ^ +Warning: 't1715' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:14: + + 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & + | ^ +note: 't1715' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: + + 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 + | ^ +Warning: 't1712' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:87: + + 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & + | ^ +note: 't1712' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:707:26: + + 707 | t537 + | ^ +Warning: 't171' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:80: + + 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & + | ^ +note: 't171' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2584:38: + + 2584 | t6004 = t1709*t178*t710 + | ^ +Warning: 't1709' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:74: + + 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & + | ^ +note: 't1709' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: + + 2087 | *t83*t45*t3581*t140 + | ^ +Warning: 't1706' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:60: + + 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & + | ^ +note: 't1706' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1893:39: + + 1893 | *t165*t3865*t237 + | ^ +Warning: 't1703' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:46: + + 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & + | ^ +note: 't1703' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: + + 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 + | ^ +Warning: 't1700' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:32: + + 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & + | ^ +note: 't1700' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2483:61: + + 2483 | t5738 = 0.4444444445e0_dp*t170*t114*t4782*t451 + | ^ +Warning: 't170' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:25: + + 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & + | ^ +note: 't170' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:707:26: + + 707 | t537 + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:19: + + 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & + | ^ +note: 't17' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: + + 2087 | *t83*t45*t3581*t140 + | ^ +Warning: 't1694' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:84: + + 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & + | ^ +note: 't1694' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: + + 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 + | ^ +Warning: 't1689' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:70: + + 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & + | ^ +note: 't1689' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2654:37: + + 2654 | t6175 = t83*t597*t1688 + | ^ +Warning: 't1688' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:63: + + 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & + | ^ +note: 't1688' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2419:33: + + 2419 | t5565 = t112*t1685 + | ^ +Warning: 't1685' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:56: + + 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & + | ^ +note: 't1685' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2403:43: + + 2403 | t5528 = t102*t327*t1684*t557 + | ^ +Warning: 't1684' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:49: + + 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & + | ^ +note: 't1684' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2392:38: + + 2392 | t5496 = t366*t368*t1681 + | ^ +Warning: 't1681' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:42: + + 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & + | ^ +note: 't1681' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2397:38: + + 2397 | t5511 = t1680*t3673*t23 + | ^ +Warning: 't1680' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:35: + + 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & + | ^ +note: 't1680' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2391:49: + + 2391 | t5494 = 0.6400000000e2_dp*t7*t1677 + | ^ +Warning: 't1677' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:21: + + 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & + | ^ +note: 't1677' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2393:44: + + 2393 | t5499 = 0.120e2_dp*t550*t1669 + | ^ +Warning: 't1669' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:89: + + 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & + | ^ +note: 't1669' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2395:52: + + 2395 | t5507 = 0.120e2_dp*t7*t640*t1667*t371 + | ^ +Warning: 't1667' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:82: + + 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & + | ^ +note: 't1667' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:707:26: + + 707 | t537 + | ^ +Warning: 't166' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:54: + + 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & + | ^ +note: 't166' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2389:52: + + 2389 | t5489 = 0.1600000000e2_dp*t1429*t1658 + | ^ +Warning: 't1658' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:48: + + 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & + | ^ +note: 't1658' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2388:54: + + 2388 | t5487 = 0.2160000000e3_dp*t7*t995*t1652 + | ^ +Warning: 't1652' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:27: + + 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & + | ^ +note: 't1652' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2499:57: + + 2499 | t5783 = 0.5555555557e-1_dp*t165*t5013*t433 + | ^ +Warning: 't165' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:20: + + 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & + | ^ +note: 't165' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2161:56: + + 2161 | t102*t4838 - 0.20e1_dp*t102*t4850 + | ^ +Warning: 't1645' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:90: + + 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & + | ^ +note: 't1645' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2386:49: + + 2386 | t5482 = 0.2160000000e3_dp*t7*t1642 + | ^ +Warning: 't1642' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:76: + + 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & + | ^ +note: 't1642' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: + + 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + | ^ +Warning: 't1640' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:69: + + 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & + | ^ +note: 't1640' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:660:31: + + 660 | t445 = t164*t444 + | ^ +Warning: 't164' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:62: + + 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & + | ^ +note: 't164' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2405:44: + + 2405 | t5533 = 0.160e2_dp*t112*t1632 + | ^ +Warning: 't1632' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:35: + + 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & + | ^ +note: 't1632' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't1631' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:28: + + 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & + | ^ +note: 't1631' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2404:44: + + 2404 | t5531 = 0.160e2_dp*t112*t1626 + | ^ +Warning: 't1626' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:91: + + 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & + | ^ +note: 't1626' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: + + 1857 | *t321*t953*t1625 + | ^ +Warning: 't1625' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:84: + + 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & + | ^ +note: 't1625' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2407:44: + + 2407 | t5537 = 0.160e2_dp*t112*t1622 + | ^ +Warning: 't1622' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:70: + + 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & + | ^ +note: 't1622' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: + + 1857 | *t321*t953*t1625 + | ^ +Warning: 't1621' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:63: + + 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & + | ^ +note: 't1621' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2370:47: + + 2370 | t5446 = 0.480e2_dp*t24*t23*t1618 + | ^ +Warning: 't1618' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:49: + + 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & + | ^ +note: 't1618' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: + + 1857 | *t321*t953*t1625 + | ^ +Warning: 't1617' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:42: + + 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & + | ^ +note: 't1617' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: + + 1865 | *t339*t969 + | ^ +Warning: 't1616' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:35: + + 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & + | ^ +note: 't1616' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2402:51: + + 2402 | t5525 = 0.2133333334e2_dp*t339*t1611 + | ^ +Warning: 't1611' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:69: + + 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 + | ^ +note: 't1611' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1441:46: + + 1441 | - t1994 + t1997 - t2000 + | ^ +Warning: 't161' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:55: + + 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 + | ^ +note: 't161' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2383:51: + + 2383 | t5474 = 0.4266666668e2_dp*t339*t1608 + | ^ +Warning: 't1608' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:49: + + 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 + | ^ +note: 't1608' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2372:44: + + 2372 | t5451 = 0.640e2_dp*t605*t1603 + | ^ +Warning: 't1603' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:28: + + 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 + | ^ +note: 't1603' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: + + 1831 | *t3339 + | ^ +Warning: 't1602' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:21: + + 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 + | ^ +note: 't1602' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:641:31: + + 641 | t394 = t393*t160 + | ^ +Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:95: + + 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & + | ^ +note: 't160' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1080:46: + + 1080 | t1439 = 0.1e1_dp/t787/t16*t1438 + | ^ +Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:89: + + 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & + | ^ +note: 't16' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2413:49: + + 2413 | t5551 = 0.1280e3_dp*t24*t298*t1599 + | ^ +Warning: 't1599' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:84: + + 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & + | ^ +note: 't1599' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't1598' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:77: + + 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & + | ^ +note: 't1598' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + + 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + | ^ +Warning: 't1597' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:70: + + 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & + | ^ +note: 't1597' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2416:52: + + 2416 | t5560 = 0.2346666666e3_dp*t1589*t1592 + | ^ +Warning: 't1592' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:49: + + 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & + | ^ +note: 't1592' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: + + 1865 | *t339*t969 + | ^ +Warning: 't1589' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:35: + + 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & + | ^ +note: 't1589' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2374:46: + + 2374 | t5456 = 0.1280e3_dp*t1582*t1426 + | ^ +Warning: 't1582' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:91: + + 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & + | ^ +note: 't1582' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: + + 2087 | *t83*t45*t3581*t140 + | ^ +Warning: 't1575' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:63: + + 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & + | ^ +note: 't1575' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2652:56: + + 2652 | t6170 = 0.3333333336e0_dp*t289*t597*t1571 + | ^ +Warning: 't1571' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:49: + + 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & + | ^ +note: 't1571' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1893:39: + + 1893 | *t165*t3865*t237 + | ^ +Warning: 't1568' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:35: + + 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & + | ^ +note: 't1568' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1893:39: + + 1893 | *t165*t3865*t237 + | ^ +Warning: 't1565' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:28: + + 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & + | ^ +note: 't1565' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2656:38: + + 2656 | t6181 = t289*t1564*t593 + | ^ +Warning: 't1564' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:21: + + 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & + | ^ +note: 't1564' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1633:65: + + 1633 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 + | ^ +Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:89: + + 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & + | ^ +note: 't156' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2666:56: + + 2666 | t6201 = 0.3333333336e0_dp*t289*t597*t1557 + | ^ +Warning: 't1557' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:83: + + 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & + | ^ +note: 't1557' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2657:56: + + 2657 | t6185 = 0.3333333336e0_dp*t289*t597*t1553 + | ^ +Warning: 't1553' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:69: + + 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & + | ^ +note: 't1553' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1621:39: + + 1621 | *t400*t401*t2230 + | ^ +Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:55: + + 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & + | ^ +note: 't155' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: + + 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 + | ^ +Warning: 't1547' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:42: + + 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & + | ^ +note: 't1547' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: + + 2079 | *t289*t294*t1553 + | ^ +Warning: 't1546' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:35: + + 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & + | ^ +note: 't1546' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: + + 2098 | t3869 + t4657 + t4696) + | ^ +Warning: 't1536' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:91: + + 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & + | ^ +note: 't1536' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2164:42: + + 2164 | t4864 = t217*t46*t1535*t561 + | ^ +Warning: 't1535' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:84: + + 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & + | ^ +note: 't1535' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: + + 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 + | ^ +Warning: 't1531' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:77: + + 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & + | ^ +note: 't1531' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2192:52: + + 2192 | t4932 = 0.5000000001e0_dp*t1528*t4908 + | ^ +Warning: 't1528' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:63: + + 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & + | ^ +note: 't1528' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2200:33: + + 2200 | t4952 = t719*t1525 + | ^ +Warning: 't1525' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:56: + + 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & + | ^ +note: 't1525' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2612:42: + + 2612 | t6066 = t1519*t705*t561*t65 + | ^ +Warning: 't1519' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:42: + + 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & + | ^ +note: 't1519' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2589:39: + + 2589 | t6021 = t649*t1518*t1722 + | ^ +Warning: 't1518' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:35: + + 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & + | ^ +note: 't1518' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2190:52: + + 2190 | t4925 = 0.5000000001e0_dp*t1513*t4908 + | ^ +Warning: 't1513' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:14: + + 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & + | ^ +note: 't1513' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: + + 1983 | t192*t68*t4256*t65 + | ^ +Warning: 't1510' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:87: + + 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & + | ^ +note: 't1510' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1395:80: + + 1395 | + t1482 + t1479 - t1489 + 0.3333333334e0_dp*t55*t57*t2042 + | ^ +Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:80: + + 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & + | ^ +note: 't151' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2184:52: + + 2184 | t4911 = 0.8999999998e1_dp*t1507*t4909 + | ^ +Warning: 't1507' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:67: + + 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & + | ^ +note: 't1507' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2181:57: + + 2181 | t4907 = 0.2250000000e2_dp*t1506*t471*t4905 + | ^ +Warning: 't1506' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:60: + + 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & + | ^ +note: 't1506' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2556:38: + + 2556 | t5938 = t192*t728*t1505 + | ^ +Warning: 't1505' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:53: + + 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & + | ^ +note: 't1505' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2606:37: + + 2606 | t6052 = t1504*t561*t65 + | ^ +Warning: 't1504' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:46: + + 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & + | ^ +note: 't1504' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2174:39: + + 2174 | t4895 = t478*t1500*t4729 + | ^ +Warning: 't1500' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:32: + + 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & + | ^ +note: 't1500' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: + + 1744 | + t3288) + | ^ +Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:25: + + 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & + | ^ +note: 't150' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2171:57: + + 2171 | t4887 = 0.1800000000e2_dp*t473*t1493*t4729 + | ^ +Warning: 't1493' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:286:90: + + 286 | REAL(KIND=dp) :: t1471, t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, & + | ^ +note: 't1493' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:570:31: + + 570 | t250 = t149*t249 + | ^ +Warning: 't149' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:286:76: + + 286 | REAL(KIND=dp) :: t1471, t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, & + | ^ +note: 't149' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2633:59: + + 2633 | t6112 = 0.5555555556e-1_dp*t1246*t4553*t1483 + | ^ +Warning: 't1483' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:286:56: + + 286 | REAL(KIND=dp) :: t1471, t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, & + | ^ +note: 't1483' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: + + 2233 | + t5032 + t5035 + | ^ +Warning: 't1471' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:286:28: + + 286 | REAL(KIND=dp) :: t1471, t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, & + | ^ +note: 't1471' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1783:38: + + 1783 | t165*t171*t3449 + | ^ +Warning: 't1470' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:74: + + 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 + | ^ +note: 't1470' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: + + 2233 | + t5032 + t5035 + | ^ +Warning: 't1466' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:61: + + 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 + | ^ +note: 't1466' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: + + 2233 | + t5032 + t5035 + | ^ +Warning: 't1459' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:48: + + 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 + | ^ +note: 't1459' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2786:32: + + 2786 | t6557 = t1447*t59 + | ^ +Warning: 't1447' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:21: + + 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 + | ^ +note: 't1447' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2406:45: + + 2406 | t5535 = 0.640e2_dp*t1582*t1444 + | ^ +Warning: 't1444' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:14: + + 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 + | ^ +note: 't1444' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2425:53: + + 2425 | t5579 = 0.80e1_dp*t102*t327*t645*t1443 + | ^ +Warning: 't1443' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:97: + + 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & + | ^ +note: 't1443' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2155:59: + + 2155 | - 0.2400000000e2_dp*t786/t2492*t1058 + | ^ +Warning: 't1440' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:90: + + 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & + | ^ +note: 't1440' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: + + 2079 | *t289*t294*t1553 + | ^ +Warning: 't144' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:83: + + 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & + | ^ +note: 't144' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1842:34: + + 1842 | t3679 = t2565*t1439 + | ^ +Warning: 't1439' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:77: + + 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & + | ^ +note: 't1439' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: + + 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + | ^ +Warning: 't1438' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:70: + + 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & + | ^ +note: 't1438' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: + + 1850 | *t786*t1034*t1681 + | ^ +Warning: 't1429' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:56: + + 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & + | ^ +note: 't1429' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2374:46: + + 2374 | t5456 = 0.1280e3_dp*t1582*t1426 + | ^ +Warning: 't1426' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:49: + + 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & + | ^ +note: 't1426' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2384:55: + + 2384 | t5478 = 0.240e2_dp*t1616*t973*t645*t1425 + | ^ +Warning: 't1425' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:42: + + 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & + | ^ +note: 't1425' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2379:51: + + 2379 | t5468 = 0.2346666666e3_dp*t605*t1420 + | ^ +Warning: 't1420' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:35: + + 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & + | ^ +note: 't1420' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: + + 2098 | t3869 + t4657 + t4696) + | ^ +Warning: 't1411' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:14: + + 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & + | ^ +note: 't1411' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2644:58: + + 2644 | t6155 = 0.2500000000e0_dp*t1981*t4032*t1410 + | ^ +Warning: 't1410' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:94: + + 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & + | ^ +note: 't1410' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:713:98: + + 713 | t46*t541))*sx + | ^ +Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:87: + + 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & + | ^ +note: 't141' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: + + 2098 | t3869 + t4657 + t4696) + | ^ +Warning: 't1409' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:81: + + 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & + | ^ +note: 't1409' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:782:70: + + 782 | *t165*t462*t561 + 0.3333333334e0_dp*t55*t57*t735 + | ^ +Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:53: + + 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & + | ^ +note: 't140' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: + + 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 + | ^ +Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:47: + + 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & + | ^ +note: 't14' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2441:57: + + 2441 | t5622 = 0.1666666667e0_dp*t165*t1392*t4729 + | ^ +Warning: 't1392' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:28: + + 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & + | ^ +note: 't1392' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2042:44: + + 2042 | + (2*t147*t1284*t672) + | ^ +Warning: 't1388' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:21: + + 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & + | ^ +note: 't1388' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: + + 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 + | ^ +Warning: 't1387' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:14: + + 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & + | ^ +note: 't1387' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: + + 2034 | *t1246*t3244*t1483 + | ^ +Warning: 't1377' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:95: + + 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & + | ^ +note: 't1377' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2366:39: + + 2366 | t5432 = t1373*t446*t5430 + | ^ +Warning: 't1373' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:88: + + 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & + | ^ +note: 't1373' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: + + 2259 | *t105*t5118 + | ^ +Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:74: + + 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & + | ^ +note: 't137' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1783:38: + + 1783 | t165*t171*t3449 + | ^ +Warning: 't1368' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:68: + + 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & + | ^ +note: 't1368' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2051:58: + + 2051 | + 0.3333333334e0_dp*t165*t437*t1688 + | ^ +Warning: 't1360' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:54: + + 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & + | ^ +note: 't1360' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:606:31: + + 606 | t328 = t136*t233 + | ^ +Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:47: + + 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & + | ^ +note: 't136' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2026:66: + + 2026 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 + | ^ +Warning: 't1348' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:41: + + 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & + | ^ +note: 't1348' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1910:40: + + 1910 | *t400*t1333*t1410 + | ^ +Warning: 't1340' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:27: + + 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & + | ^ +note: 't1340' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2448:57: + + 2448 | t5641 = 0.1500000000e1_dp*t405*t1333*t4729 + | ^ +Warning: 't1333' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:20: + + 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & + | ^ +note: 't1333' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: + + 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 + | ^ +Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:13: + + 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & + | ^ +note: 't133' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: + + 1923 | t1320*t1483 + | ^ +Warning: 't1320' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:93: + + 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & + | ^ +note: 't1320' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: + + 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 + | ^ +Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:86: + + 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & + | ^ +note: 't132' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: + + 1923 | t1320*t1483 + | ^ +Warning: 't1316' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:80: + + 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & + | ^ +note: 't1316' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1536:43: + + 1536 | t2565 = t126/t131/t1056/t130 + | ^ +Warning: 't131' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:73: + + 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & + | ^ +note: 't131' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2459:57: + + 2459 | t5670 = 0.2250000000e1_dp*t400*t1309*t4729 + | ^ +Warning: 't1309' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:67: + + 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & + | ^ +note: 't1309' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2463:57: + + 2463 | t5679 = 0.1875000000e1_dp*t1302*t406*t5002 + | ^ +Warning: 't1302' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:60: + + 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & + | ^ +note: 't1302' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1900:33: + + 1900 | t3939 = t1301*t245 + | ^ +Warning: 't1301' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:53: + + 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & + | ^ +note: 't1301' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: + + 2716 | + 0.4500000000e1_dp*t2009*t4744 + | ^ +Warning: 't1300' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:46: + + 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & + | ^ +note: 't1300' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1536:43: + + 1536 | t2565 = t126/t131/t1056/t130 + | ^ +Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:39: + + 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & + | ^ +note: 't130' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:808:44: + + 808 | t796 = 0.1e1_dp/t787/t13*t795 + | ^ +Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:33: + + 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & + | ^ +note: 't13' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2364:57: + + 2364 | t5429 = 0.1666666667e0_dp*t445*t1292*t5143 + | ^ +Warning: 't1292' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:28: + + 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & + | ^ +note: 't1292' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2042:44: + + 2042 | + (2*t147*t1284*t672) + | ^ +Warning: 't1284' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:14: + + 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & + | ^ +note: 't1284' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2019:39: + + 2019 | *t429*t1928*t290 + | ^ +Warning: 't1283' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:96: + + 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & + | ^ +note: 't1283' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2061:71: + + 2061 | *t3507 - t3512)*t149*t160 + | ^ +Warning: 't1275' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:89: + + 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & + | ^ +note: 't1275' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2026:66: + + 2026 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 + | ^ +Warning: 't1264' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:75: + + 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & + | ^ +note: 't1264' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: + + 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 + | ^ +Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:68: + + 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & + | ^ +note: 't126' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2497:59: + + 2497 | t5776 = 0.2777777778e-1_dp*t1246*t1247*t5009 + | ^ +Warning: 't1247' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:55: + + 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & + | ^ +note: 't1247' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2497:59: + + 2497 | t5776 = 0.2777777778e-1_dp*t1246*t1247*t5009 + | ^ +Warning: 't1246' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:48: + + 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & + | ^ +note: 't1246' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: + + 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + | ^ +Warning: 't1235' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:27: + + 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & + | ^ +note: 't1235' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: + + 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 + | ^ +Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:20: + + 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & + | ^ +note: 't123' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: + + 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + | ^ +Warning: 't1224' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:14: + + 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & + | ^ +note: 't1224' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: + + 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 + | ^ +Warning: 't1221' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:95: + + 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & + | ^ +note: 't1221' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:619:81: + + 619 | t360 = 0.28e2_dp/0.3e1_dp*t122*t114 - 0.28e2_dp/0.3e1_dp*t356*t357 + | ^ +Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:88: + + 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & + | ^ +note: 't122' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: + + 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 + | ^ +Warning: 't1216' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:82: + + 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & + | ^ +note: 't1216' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: + + 1983 | t192*t68*t4256*t65 + | ^ +Warning: 't1213' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:75: + + 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & + | ^ +note: 't1213' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: + + 1954 | *t58*t3796*t71 + | ^ +Warning: 't1207' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:61: + + 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & + | ^ +note: 't1207' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: + + 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 + | ^ +Warning: 't1201' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:47: + + 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & + | ^ +note: 't1201' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: + + 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + | ^ +Warning: 't1200' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:40: + + 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & + | ^ +note: 't1200' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1803:35: + + 1803 | t3546 = 0.1e1_dp/t12 + | ^ +Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:33: + + 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & + | ^ +note: 't12' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: + + 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + | ^ +Warning: 't1194' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:28: + + 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & + | ^ +note: 't1194' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1940:66: + + 1940 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 + | ^ +Warning: 't1193' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:69: + + 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 + | ^ +note: 't1193' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: + + 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + | ^ +Warning: 't1192' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:62: + + 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 + | ^ +note: 't1192' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: + + 1841 | + 0.3200000000e2_dp*t1055*t3674 + | ^ +Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:48: + + 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 + | ^ +note: 't119' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: + + 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + | ^ +Warning: 't1189' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:42: + + 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 + | ^ +note: 't1189' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1975:29: + + 1975 | *t3382 + | ^ +Warning: 't1176' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:35: + + 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 + | ^ +note: 't1176' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: + + 2034 | *t1246*t3244*t1483 + | ^ +Warning: 't1172' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:28: + + 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 + | ^ +note: 't1172' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: + + 2034 | *t1246*t3244*t1483 + | ^ +Warning: 't1168' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:21: + + 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 + | ^ +note: 't1168' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: + + 1965 | *t478*t183*t3918 + | ^ +Warning: 't1161' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:14: + + 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 + | ^ +note: 't1161' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: + + 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 + | ^ +Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:95: + + 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't116' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1975:29: + + 1975 | *t3382 + | ^ +Warning: 't1157' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:89: + + 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1157' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2528:57: + + 2528 | t5864 = 0.1800000000e2_dp*t473*t1150*t4729 + | ^ +Warning: 't1150' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:82: + + 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1150' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1187:50: + + 1187 | t1636 = 0.5600000000e2_dp*t624*t115 + | ^ +Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:75: + + 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't115' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2505:57: + + 2505 | t5801 = 0.3600000000e2_dp*t1143*t479*t5002 + | ^ +Warning: 't1143' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:69: + + 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1143' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1966:33: + + 1966 | t4230 = t1142*t262 + | ^ +Warning: 't1142' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:62: + + 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1142' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2613:63: + + 2613 | t6074 = 0.8099999996e2_dp*t496*t4769*t1141*t4915 + | ^ +Warning: 't1141' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:55: + + 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1141' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:619:81: + + 619 | t360 = 0.28e2_dp/0.3e1_dp*t122*t114 - 0.28e2_dp/0.3e1_dp*t356*t357 + | ^ +Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:41: + + 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't114' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: + + 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + | ^ +Warning: 't1137' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:35: + + 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1137' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: + + 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + | ^ +Warning: 't1134' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:28: + + 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1134' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: + + 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 + | ^ +Warning: 't1129' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:21: + + 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1129' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: + + 1954 | *t58*t3796*t71 + | ^ +Warning: 't1126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:14: + + 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + | ^ +note: 't1126' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: + + 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 + | ^ +Warning: 't1125' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:95: + + 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1125' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: + + 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 + | ^ +Warning: 't1122' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:88: + + 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1122' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2419:33: + + 2419 | t5565 = t112*t1685 + | ^ +Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:81: + + 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't112' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: + + 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 + | ^ +Warning: 't1119' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:75: + + 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1119' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: - 4927 | - 0.2400000000e2_dp*t786/t2492*t1058 - | ^ -Warning: 't2492' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:68: + 1954 | *t58*t3796*t71 + | ^ +Warning: 't1111' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:68: - 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & + 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ -note: 't2492' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4295:40: +note: 't1111' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: - 4295 | *t1368*t166*t2160 - | ^ -Warning: 't249' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:61: + 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 + | ^ +Warning: 't1109' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:61: - 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & + 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & | ^ -note: 't249' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: +note: 't1109' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1940:66: - 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + 1940 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 | ^ -Warning: 't2480' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:55: - - 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & - | ^ -note: 't2480' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: - - 4629 | *t321*t953*t1625 - | ^ -Warning: 't2468' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:48: - - 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & - | ^ -note: 't2468' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5154:57: +Warning: 't1106' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:54: - 5154 | t5472 = 0.3200000001e2_dp*t321*t2455*t5079 - | ^ -Warning: 't2455' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:41: + 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1106' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: - 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & + 1983 | t192*t68*t4256*t65 | ^ -note: 't2455' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4099:32: - - 4099 | t1912 = t399*t245 - | ^ -Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3094:27: +Warning: 't1101' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:47: - 3094 | t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, t2552, & - | ^ -note: 't245' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: + 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1101' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: - 4851 | *t289*t294*t1553 - | ^ -Warning: 't2404' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:79: + 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 + | ^ +Warning: 't1100' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:40: - 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & - | ^ -note: 't2404' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3387:30: + 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1100' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:608:30: - 3387 | t350 = t24*t225 + 608 | t332 = t11*t114 | ^ -Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:72: - - 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & - | ^ -note: 't24' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: +Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:33: - 4516 | + t3288) - | ^ -Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:46: + 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't11' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: - 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & - | ^ -note: 't237' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3924:44: + 1983 | t192*t68*t4256*t65 + | ^ +Warning: 't1097' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:21: - 3924 | t1584 = 0.320e2_dp*t1582*t234 - | ^ -Warning: 't234' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:26: + 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1097' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: - 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & - | ^ -note: 't234' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4330:85: + 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 + | ^ +Warning: 't1093' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:14: - 4330 | - 0.20e1_dp*t102*t105*t2569 - 0.6400000001e2_dp*t321*t953*t979 - | ^ -Warning: 't233' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3093:20: + 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + | ^ +note: 't1093' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: - 3093 | t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, t2424, & - | ^ -note: 't233' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3855:53: + 2034 | *t1246*t3244*t1483 + | ^ +Warning: 't1085' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:89: - 3855 | + 0.8000000000e1_dp*t366*t1440 - | ^ -Warning: 't230' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3092:46: + 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't1085' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:740:45: - 3092 | t2292, t2295, t2296, t2299, t23, t230, t2300, t2304, t2307, t2308, t2311, t2312, t2319, & - | ^ -note: 't230' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3945:29: + 740 | t635 = -4*t108 + 4*t332*my_rho + | ^ +Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:75: - 3945 | t1616 = t7*t23 - | ^ -Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3092:40: + 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't108' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2318:57: - 3092 | t2292, t2295, t2296, t2299, t23, t230, t2300, t2304, t2307, t2308, t2311, t2312, t2319, & - | ^ -note: 't23' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4422:31: + 2318 | t5311 = 0.1666666668e0_dp*t289*t1071*t4701 + | ^ +Warning: 't1071' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:55: - 4422 | t2998 = t27*t225 - | ^ -Warning: 't225' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:87: + 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't1071' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: - 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & - | ^ -note: 't225' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3659:40: + 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 + | ^ +Warning: 't107' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:48: - 3659 | t995 = 0.1e1_dp/t787/t224 - | ^ -Warning: 't224' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:81: + 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't107' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2053:33: - 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & - | ^ -note: 't224' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: + 2053 | t4575 = t1067*t561 + | ^ +Warning: 't1067' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:35: - 4622 | *t786*t1034*t1681 - | ^ -Warning: 't2220' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:54: + 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't1067' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: - 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & - | ^ -note: 't2220' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3859:28: + 1831 | *t3339 + | ^ +Warning: 't1064' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:28: - 3859 | t1444 + 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & | ^ -Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:47: - - 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & - | ^ -note: 't221' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: +note: 't1064' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: - 4322 | *t2565*t796 - | ^ -Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3090:13: + 1857 | *t321*t953*t1625 + | ^ +Warning: 't1063' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:21: - 3090 | t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, t2257, & - | ^ -note: 't220' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3377:30: + 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't1063' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2725:40: - 3377 | t327 = t22*t326 - | ^ -Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:93: + 2725 | *t1054*t640*t3679 + | ^ +Warning: 't1060' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:14: - 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & - | ^ -note: 't22' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3657:31: + 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + | ^ +note: 't1060' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1461:31: - 3657 | t987 = t219*t341 + 1461 | t2204 = t10*t106 | ^ -Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:60: +Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:95: - 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & - | ^ -note: 't219' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: + 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't106' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2155:59: - 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 - | ^ -Warning: 't2182' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:40: + 2155 | - 0.2400000000e2_dp*t786/t2492*t1058 + | ^ +Warning: 't1058' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:82: - 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & - | ^ -note: 't2182' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4322:34: + 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't1058' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2400:67: - 4322 | *t2565*t796 - | ^ -Warning: 't218' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:33: + 2400 | *t5511 + 0.1200000000e3_dp*t1055*t2565*t4721 + | ^ +Warning: 't1055' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:68: - 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & - | ^ -note: 't218' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4936:42: + 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't1055' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2725:40: - 4936 | t4864 = t217*t46*t1535*t561 - | ^ -Warning: 't217' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3089:27: + 2725 | *t1054*t640*t3679 + | ^ +Warning: 't1054' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:61: - 3089 | REAL(kind=dp) :: t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, t22, & - | ^ -note: 't217' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4873:56: + 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't1054' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: - 4873 | t4704 = 0.3333333336e0_dp*t2147*t84*t4701 - | ^ -Warning: 't2147' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3088:55: + 1850 | *t786*t1034*t1681 + | ^ +Warning: 't1050' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:54: - 3088 | t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160, t2169 - | ^ -note: 't2147' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4908:55: + 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't1050' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:565:31: - 4908 | t4789 = 0.4444444448e0_dp*t214*t46*t4786 - | ^ -Warning: 't214' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3088:41: + 565 | t234 = t105*t233 + | ^ +Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:47: - 3088 | t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160, t2169 + 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't105' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: + + 1841 | + 0.3200000000e2_dp*t1055*t3674 + | ^ +Warning: 't1046' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:41: + + 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & | ^ -note: 't214' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5510:79: +note: 't1046' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: - 5510 | *t6181 - t6185 + t6189 - t6192 - 0.3333333336e0_dp*t6194 - | ^ -Warning: 't2139' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3088:35: + 1841 | + 0.3200000000e2_dp*t1055*t3674 + | ^ +Warning: 't1044' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:34: - 3088 | t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160, t2169 - | ^ -note: 't2139' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5525:90: + 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't1044' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:599:30: - 5525 | t5418 + 0.1800000000e2_dp*t658*t575*t2074 + 0.1800000000e2_dp*t5421 - | ^ -Warning: 't2131' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3088:21: + 599 | t316 = t97*t104 + | ^ +Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:20: - 3088 | t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160, t2169 - | ^ -note: 't2131' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5562:82: + 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't104' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: - 5562 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 - | ^ -Warning: 't2126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:91: + 1850 | *t786*t1034*t1681 + | ^ +Warning: 't1036' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:14: - 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & - | ^ -note: 't2126' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5582:46: + 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + | ^ +note: 't1036' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: - 5582 | *t60*t2124*t709 - t6044 - | ^ -Warning: 't2124' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:84: + 1850 | *t786*t1034*t1681 + | ^ +Warning: 't1034' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:96: - 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & - | ^ -note: 't2124' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5562:82: + 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't1034' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: - 5562 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 + 1850 | *t786*t1034*t1681 + | ^ +Warning: 't1030' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:82: + + 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ -Warning: 't2118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:77: +note: 't1030' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:876:29: - 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & - | ^ -note: 't2118' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5566:41: + 876 | t972 = t103**2 + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:75: - 5566 | *t5228*t2117*t2028 - | ^ -Warning: 't2117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:70: + 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't103' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: - 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & - | ^ -note: 't2117' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5562:82: + 1850 | *t786*t1034*t1681 + | ^ +Warning: 't1026' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:69: - 5562 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 - | ^ -Warning: 't2114' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:63: + 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't1026' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: - 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & - | ^ -note: 't2114' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5582:46: + 1850 | *t786*t1034*t1681 + | ^ +Warning: 't1024' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:62: - 5582 | *t60*t2124*t709 - t6044 - | ^ -Warning: 't2113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:56: + 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't1024' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: - 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & - | ^ -note: 't2113' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5572:60: + 1850 | *t786*t1034*t1681 + | ^ +Warning: 't1021' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:55: - 5572 | t6260 + 0.8999999998e1_dp*t5229*t2104 - | ^ -Warning: 't2104' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:42: + 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't1021' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2403:43: - 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & - | ^ -note: 't2104' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5550:29: + 2403 | t5528 = t102*t327*t1684*t557 + | ^ +Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:48: - 5550 | *t6271 - | ^ -Warning: 't2099' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:35: + 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & + | ^ +note: 't102' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1764:32: - 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + 1764 | t12*t1058 + | ^ +Warning: 't1014' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:35: + + 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ -note: 't2099' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5566:41: +note: 't1014' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: - 5566 | *t5228*t2117*t2028 - | ^ -Warning: 't2098' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:28: + 1850 | *t786*t1034*t1681 + | ^ +Warning: 't1012' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:28: - 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ -note: 't2098' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5562:82: +note: 't1012' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: - 5562 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 - | ^ -Warning: 't2095' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:21: + 1850 | *t786*t1034*t1681 + | ^ +Warning: 't1008' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:21: - 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ -note: 't2095' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: +note: 't1008' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: - 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) - | ^ -Warning: 't2088' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3087:14: + 1841 | + 0.3200000000e2_dp*t1055*t3674 + | ^ +Warning: 't1004' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:14: - 3087 | t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, t2126, & + 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & | ^ -note: 't2088' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: +note: 't1004' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: - 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) - | ^ -Warning: 't2082' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:90: + 1831 | *t3339 + | ^ +Warning: 't1000' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:272:90: - 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & + 272 | REAL(KIND=dp) :: Cx, epsilon_rho43, my_epsilon_rho, my_ndrho, my_rho, t1, t10, t1000, t1002, & | ^ -note: 't2082' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5540:38: +note: 't1000' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:895:50: - 5540 | - t6090 + t6094 - | ^ -Warning: 't2081' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:83: + 895 | t1019 = 0.1e1_dp/t19/t1014*t787*t10 + | ^ +Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:272:83: - 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & + 272 | REAL(KIND=dp) :: Cx, epsilon_rho43, my_epsilon_rho, my_ndrho, my_rho, t1, t10, t1000, t1002, & | ^ -note: 't2081' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: +note: 't10' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xbecke88_lr_adiabatic.mod' due to: xc_xbecke88_lr_adiabatic.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod cp_array_utils.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_lyp.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_lyp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_lyp.F xc_lyp.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:21:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_lyp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_lyp.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_lyp.mod' due to: xc_lyp.o /build/reproducible-path/cp2k-8.1/src/xc/xc_lyp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_thomas_fermi.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_thomas_fermi.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod kinds.mod cp_array_utils.mod xc_functionals_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_thomas_fermi.F xc_thomas_fermi.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:21:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_thomas_fermi.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_thomas_fermi.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_thomas_fermi.mod' due to: xc_thomas_fermi.o /build/reproducible-path/cp2k-8.1/src/xc/xc_thomas_fermi.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod kinds.mod cp_array_utils.mod xc_functionals_utilities.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_b97.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_b97.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod xc_input_constants.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_b97.F xc_b97.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:21:24 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_b97.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_b97.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_b97.mod' due to: xc_b97.o /build/reproducible-path/cp2k-8.1/src/xc/xc_b97.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod xc_input_constants.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_exchange_gga.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_exchange_gga.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod mathconstants.mod cp_log_handling.mod kinds.mod cp_array_utils.mod xc_functionals_utilities.mod xc_input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_exchange_gga.F xc_exchange_gga.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:21:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_exchange_gga.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_exchange_gga.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_exchange_gga.mod' due to: xc_exchange_gga.o /build/reproducible-path/cp2k-8.1/src/xc/xc_exchange_gga.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod mathconstants.mod cp_log_handling.mod kinds.mod cp_array_utils.mod xc_functionals_utilities.mod xc_input_constants.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_perdew_zunger.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod kinds.mod xc_functionals_utilities.mod xc_input_constants.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F xc_perdew_zunger.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:21:40 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_perdew_zunger.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_perdew_zunger.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:714:74: - 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) - | ^ -Warning: 't2077' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:76: + 714 | + trz*r(1)*z(0, 2) + tzz*z(0, 2)*z(1, 0) + tz*z(1, 2) + | ^ +Warning: 'tzz' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:617:63: - 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & - | ^ -note: 't2077' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5525:90: + 617 | tzz, tzzz + | ^ +note: 'tzz' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:682:56: - 5525 | t5418 + 0.1800000000e2_dp*t658*t575*t2074 + 0.1800000000e2_dp*t5421 - | ^ -Warning: 't2074' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:69: + 682 | + tr*r(2) + tzz*z(1, 0)**2 + tz*z(2, 0) + | ^ +Warning: 'trz' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:89: - 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & - | ^ -note: 't2074' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: + 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +note: 'trz' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:682:56: - 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 - | ^ -Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:55: + 682 | + tr*r(2) + tzz*z(1, 0)**2 + tz*z(2, 0) + | ^ +Warning: 'trr' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:72: - 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & - | ^ -note: 't207' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5511:33: + 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +note: 'trr' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:675:41: - 5511 | t6400 = t2061*t561 - | ^ -Warning: 't2061' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:49: + 675 | ed(m + 1) = tr*r(1) + tz*z(0, 1) + | ^ +Warning: 'tz' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:99: - 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & - | ^ -note: 't2061' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5503:78: + 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +note: 'tz' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:673:37: - 5503 | - t5595 + t5597 - t5600 - t5602 + t5604 + t5607 + t5610 - | ^ -Warning: 't2058' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:42: + 673 | ed(m) = tr*r(1) + tz*z(1, 0) + | ^ +Warning: 'tr' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:67: - 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & - | ^ -note: 't2058' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5493:79: + 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +note: 'tr' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:720:62: - 5493 | *t327*t2057*t557 - t5456 + t5459 - t5462 + t5466 - t5468 - | ^ -Warning: 't2057' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:35: + 720 | + 3.0_dp*tzz*z(0, 1)*z(0, 2) + tz*z(0, 3) + | ^ +Warning: 'tzzz' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:617:69: - 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & - | ^ -note: 't2057' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5497:40: + 617 | tzz, tzzz + | ^ +note: 'tzzz' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:706:74: - 5497 | *t1054*t640*t3679 - | ^ -Warning: 't2054' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:28: + 706 | + trz*r(1)*z(2, 0) + tzz*z(2, 0)*z(0, 1) + tz*z(2, 1) + | ^ +Warning: 'trzz' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:95: - 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & - | ^ -note: 't2054' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5597:132: + 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +note: 'trzz' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:698:58: - 5597 | + t6442 + t6451 + t6461 + t6479 + t6490 + t6499 + t6658) - | ^ -Warning: 't2050' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:21: + 698 | + 3.0_dp*tzz*z(1, 0)*z(2, 0) + tz*z(3, 0) + | ^ +Warning: 'trrz' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:84: - 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & - | ^ -note: 't2050' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5601:73: + 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +note: 'trrz' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:698:58: - 5601 | t43*t46*t6339 + t8*(t6344 + t6380 + t6389 + t6665) - | ^ -Warning: 't2046' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3086:14: + 698 | + 3.0_dp*tzz*z(1, 0)*z(2, 0) + tz*z(3, 0) + | ^ +Warning: 'trrr' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F:616:78: - 3086 | t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, t2086, & - | ^ -note: 't2046' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5536:63: + 616 | REAL(KIND=dp) :: rho, tr, trr, trrr, trrz, trz, trzz, tz, & + | ^ +note: 'trrr' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_perdew_zunger.mod' due to: xc_perdew_zunger.o /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_zunger.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod kinds.mod xc_functionals_utilities.mod xc_input_constants.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xalpha.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xalpha.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod kinds.mod cp_array_utils.mod xc_functionals_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xalpha.F xc_xalpha.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:21:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xalpha.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xalpha.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xalpha.mod' due to: xc_xalpha.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xalpha.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod kinds.mod cp_array_utils.mod xc_functionals_utilities.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xlda_hole_t_c_lr.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathlib.mod mathconstants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F xc_xlda_hole_t_c_lr.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:21:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xlda_hole_t_c_lr.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xlda_hole_t_c_lr.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: - 5536 | *t575*t161*t1447 + t5773 + t5776 + t5780 - | ^ -Warning: 't2042' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:97: + 291 | /0.3e1_dp - C*t15*t3*t6*t4*t25))*sx + | ^ +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F:291:102: Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xlda_hole_t_c_lr.mod' due to: xc_xlda_hole_t_c_lr.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xlda_hole_t_c_lr.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathlib.mod mathconstants.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_pade.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_pade.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod kinds.mod xc_functionals_utilities.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_pade.F xc_pade.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:21:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_pade.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_pade.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_pade.mod' due to: xc_pade.o /build/reproducible-path/cp2k-8.1/src/xc/xc_pade.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod kinds.mod xc_functionals_utilities.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_optx.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_optx.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod kinds.mod cp_array_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_optx.F xc_optx.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:21:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_optx.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_optx.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_optx.mod' due to: xc_optx.o /build/reproducible-path/cp2k-8.1/src/xc/xc_optx.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod kinds.mod cp_array_utils.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_tfw.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_tfw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod kinds.mod cp_array_utils.mod xc_functionals_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_tfw.F xc_tfw.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:21:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_tfw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_tfw.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_tfw.mod' due to: xc_tfw.o /build/reproducible-path/cp2k-8.1/src/xc/xc_tfw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod kinds.mod cp_array_utils.mod xc_functionals_utilities.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_lyp_adiabatic.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F xc_lyp_adiabatic.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:22:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_lyp_adiabatic.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_lyp_adiabatic.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:656:132: - 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & - | ^ -note: 't2042' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5592:76: + 656 | + t18*t90*t421*d - REAL(2*t95*t96*my_rhob*t108*my_ndrho, dp)) + | ^ +Warning: 't96' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:91: - 5592 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) - | ^ -Warning: 't2035' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:90: + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't96' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:656:132: - 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & - | ^ -note: 't2035' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5582:46: + 656 | + t18*t90*t421*d - REAL(2*t95*t96*my_rhob*t108*my_ndrho, dp)) + | ^ +Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:86: - 5582 | *t60*t2124*t709 - t6044 - | ^ -Warning: 't2032' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:83: + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't95' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:643:132: - 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & - | ^ -note: 't2032' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5515:46: + 643 | my_ndrhoa, dp) - 0.2222222222e0_dp*t115*my_rhoa*t355)) + | ^ +Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:81: - 5515 | *t27*t6291*t172 - t5397 - | ^ -Warning: 't2031' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:76: + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't94' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:600:40: - 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & + 600 | t250 = 4*t18*t78*t141*t91 + | ^ +Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:76: + + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 | ^ -note: 't2031' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3438:30: +note: 't91' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: - 3438 | t466 = t27*t203 - | ^ -Warning: 't203' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:69: + 619 | t300 - 0.1111111111e0_dp*t115*t188) + | ^ +Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:71: - 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & - | ^ -note: 't203' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5566:41: + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't90' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:592:37: - 5566 | *t5228*t2117*t2028 - | ^ -Warning: 't2028' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:63: + 592 | t216 = 0.1e1_dp/t77/t9 + | ^ +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:66: - 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & - | ^ -note: 't2028' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5550:29: + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't9' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:597:59: - 5550 | *t6271 - | ^ -Warning: 't2027' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:56: + 597 | t231 = t14*t223*t225*lambda*t17*t87/0.3e1_dp + | ^ +Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:62: - 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & - | ^ -note: 't2027' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't87' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: - 5005 | + t5032 + t5035 + 619 | t300 - 0.1111111111e0_dp*t115*t188) + | ^ +Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:57: + + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't86' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:569:38: + + 569 | t153 = 0.1e1_dp/t21/t84 | ^ -Warning: 't2022' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:49: +Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:47: - 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & - | ^ -note: 't2022' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't84' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:631:108: - 5488 | + 0.4500000000e1_dp*t2009*t4744 - | ^ -Warning: 't2018' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:42: + 631 | - t300 - 0.1111111111e0_dp*t115*t316) + | ^ +Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:37: - 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't80' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:606:42: + + 606 | t280 = t102*t169*t78*lambda | ^ -note: 't2018' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: +Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:32: - 5488 | + 0.4500000000e1_dp*t2009*t4744 - | ^ -Warning: 't2014' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:35: + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't78' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:592:37: - 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & - | ^ -note: 't2014' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: + 592 | t216 = 0.1e1_dp/t77/t9 + | ^ +Warning: 't77' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:27: - 5488 | + 0.4500000000e1_dp*t2009*t4744 - | ^ -Warning: 't2013' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:28: + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't77' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:605:31: - 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & - | ^ -note: 't2013' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: + 605 | t276 = d*t76*t10 + | ^ +Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:22: - 5488 | + 0.4500000000e1_dp*t2009*t4744 - | ^ -Warning: 't2009' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3085:21: + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't76' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:593:71: - 3085 | t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, t2042, & - | ^ -note: 't2009' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4667:32: + 593 | t220 = 0.26666666666666666667e1_dp*t74/t21/t19*t216*t103 + | ^ +Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:17: - 4667 | t3875 = t45*t2002 - | ^ -Warning: 't2002' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:94: + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't74' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:656:132: - 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & - | ^ -note: 't2002' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3549:87: + 656 | + t18*t90*t421*d - REAL(2*t95*t96*my_rhob*t108*my_ndrho, dp)) + | ^ +Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:465:12: - 3549 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 - | ^ -Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:73: + 465 | t73, t74, t76, t77, t78, t80, t83, t84, t85, t86, t87, t9, t90, t91, t94, t95, t96, t97 + | ^ +note: 't73' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:599:66: - 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & - | ^ -note: 't200' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4127:31: + 599 | t246 = 0.2e1_dp/0.3e1_dp*t14*t17*t216*t225*t67*t103 + | ^ +Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:90: - 4127 | t1972 = t177*t20 - | ^ -Warning: 't20' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:67: + 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & + | ^ +note: 't67' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:639:61: - 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & - | ^ -note: 't20' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3465:31: + 639 | *t355) + REAL(2*t65*my_ndrhoa, dp) + | ^ +Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:85: - 3465 | t534 = t199*t267 - | ^ -Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:41: + 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & + | ^ +note: 't65' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:647:61: - 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & + 647 | *t387) + REAL(2*t63*my_ndrhob, dp) + | ^ +Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:80: + + 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & + | ^ +note: 't63' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:561:41: + + 561 | t135 = 0.1e1_dp/t6/t19*t78 | ^ -note: 't199' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5250:56: +Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:70: - 5250 | t5722 = 0.1111111111e0_dp*t165*t689*t1988 - | ^ -Warning: 't1988' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:35: + 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & + | ^ +note: 't6' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:627:67: - 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & - | ^ -note: 't1988' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4798:66: + 627 | *t48 + (t199 - 0.6666666667e0_dp*my_rhob)*t47 + | ^ +Warning: 't58' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:66: - 4798 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 + 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & | ^ -Warning: 't1981' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3084:14: +note: 't58' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:615:60: - 3084 | t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, t2002, & - | ^ -note: 't1981' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5129:43: + 615 | /0.3e1_dp*t285)*t55 + | ^ +Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:61: - 5129 | t5421 = t657*t1884*t59*t1975 - | ^ -Warning: 't1975' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:83: + 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & + | ^ +note: 't55' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:639:61: - 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & - | ^ -note: 't1975' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5528:70: + 639 | *t355) + REAL(2*t65*my_ndrhoa, dp) + | ^ +Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:56: - 5528 | + t5619 + t5622 - t5625 - t5628 + t5631 + t5716 - | ^ -Warning: 't1974' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:76: + 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & + | ^ +note: 't51' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:568:51: - 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & - | ^ -note: 't1974' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: + 568 | t151 = t14*t146*t141*t67*t5/0.3e1_dp + | ^ +Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:51: - 5488 | + 0.4500000000e1_dp*t2009*t4744 - | ^ -Warning: 't1973' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:69: + 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & + | ^ +note: 't5' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:613:26: - 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & - | ^ -note: 't1973' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5403:63: + 613 | *t49 + | ^ +Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:47: - 5403 | t6106 = 0.3600000000e2_dp*t1971*t1972*t1973*t672 - | ^ -Warning: 't1972' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:62: + 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & + | ^ +note: 't49' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:590:132: - 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & - | ^ -note: 't1972' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5403:63: + 590 | *my_rhoa + t196)*t48 + t200*t47 + | ^ +Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:42: - 5403 | t6106 = 0.3600000000e2_dp*t1971*t1972*t1973*t672 - | ^ -Warning: 't1971' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:55: + 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & + | ^ +note: 't48' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:627:67: - 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & - | ^ -note: 't1971' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5393:57: + 627 | *t48 + (t199 - 0.6666666667e0_dp*my_rhob)*t47 + | ^ +Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:37: - 5393 | t6087 = 0.1666666667e0_dp*t429*t1966*t1410 - | ^ -Warning: 't1966' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:41: + 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & + | ^ +note: 't47' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:639:61: - 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & - | ^ -note: 't1966' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5077:68: + 639 | *t355) + REAL(2*t65*my_ndrhoa, dp) + | ^ +Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:464:32: - 5077 | *t462*t4729 + 0.3333333334e0_dp*t55*t57*t5276 - | ^ -Warning: 't1962' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:27: + 464 | REAL(KIND=dp) :: t421, t46, t47, t48, t49, t5, t51, t55, t58, t6, t62, t63, t65, t67, t7, & + | ^ +note: 't46' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:610:26: - 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & - | ^ -note: 't1962' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3549:87: + 610 | *t42 + | ^ +Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:463:73: - 3549 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 - | ^ -Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3083:13: + 463 | t32, t325, t348, t351, t355, t362, t387, t39, t394, t4, t41, t42 + | ^ +note: 't42' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:653:103: - 3083 | t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, t1980, & - | ^ -note: 't196' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3460:30: + 653 | t421 = REAL(2*t25*t41*my_ndrho, dp) - 0.1333333333e1_dp*REAL(t19, dp)*REAL(my_ndrho, dp) + | ^ +Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:463:68: - 3460 | t520 = t195*t25 - | ^ -Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3082:75: + 463 | t32, t325, t348, t351, t355, t362, t387, t39, t394, t4, t41, t42 + | ^ +note: 't41' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:627:67: - 3082 | REAL(kind=dp) :: t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, t1958, & - | ^ -note: 't195' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4814:44: + 627 | *t48 + (t199 - 0.6666666667e0_dp*my_rhob)*t47 + | ^ +Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:463:12: - 4814 | + (2*t147*t1284*t672) - | ^ -Warning: 't1940' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3082:55: + 463 | t32, t325, t348, t351, t355, t362, t387, t39, t394, t4, t41, t42 + | ^ +note: 't32' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:645:34: - 3082 | REAL(kind=dp) :: t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, t1958, & - | ^ -note: 't1940' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3462:36: + 645 | t387 = t3*my_ndrhob + | ^ +Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:462:69: - 3462 | t527 = t194*t187*t526 - | ^ -Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3082:48: + 462 | t266, t27, t270, t273, t276, t28, t280, t285, t288, t294, t3, t30, t300, t307, t31, t316, & + | ^ +note: 't3' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:590:132: - 3082 | REAL(kind=dp) :: t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, t1958, & - | ^ -note: 't194' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: + 590 | *my_rhoa + t196)*t48 + t200*t47 + | ^ +Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:462:41: - 4806 | *t1246*t3244*t1483 + 462 | t266, t27, t270, t273, t276, t28, t280, t285, t288, t294, t3, t30, t300, t307, t31, t316, & | ^ -Warning: 't1932' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3082:28: - - 3082 | REAL(kind=dp) :: t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, t1958, & - | ^ -note: 't1932' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5413:38: +note: 't28' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:647:61: - 5413 | t6138 = t429*t1928*t593 - | ^ -Warning: 't1928' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3081:62: + 647 | *t387) + REAL(2*t63*my_ndrhob, dp) + | ^ +Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:461:76: - 3081 | t1914, t1917, t192, t1920, t1923, t1924, t1925, t1928 - | ^ -note: 't1928' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5414:38: + 461 | t212, t216, t220, t222, t223, t225, t23, t231, t237, t24, t246, t25, t250, t259, t26, & + | ^ +note: 't25' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: - 5414 | t6141 = t658*t575*t1925 - | ^ -Warning: 't1925' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3081:55: + 619 | t300 - 0.1111111111e0_dp*t115*t188) + | ^ +Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:461:65: - 3081 | t1914, t1917, t192, t1920, t1923, t1924, t1925, t1928 - | ^ -note: 't1925' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4823:58: + 461 | t212, t216, t220, t222, t223, t225, t23, t231, t237, t24, t246, t25, t250, t259, t26, & + | ^ +note: 't24' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:643:132: - 4823 | + 0.3333333334e0_dp*t165*t437*t1688 - | ^ -Warning: 't1924' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3081:48: + 643 | my_ndrhoa, dp) - 0.2222222222e0_dp*t115*my_rhoa*t355)) + | ^ +Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:461:48: - 3081 | t1914, t1917, t192, t1920, t1923, t1924, t1925, t1928 + 461 | t212, t216, t220, t222, t223, t225, t23, t231, t237, t24, t246, t25, t250, t259, t26, & | ^ -note: 't1924' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5328:38: - - 5328 | t5938 = t192*t728*t1505 - | ^ -Warning: 't192' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3081:27: - - 3081 | t1914, t1917, t192, t1920, t1923, t1924, t1925, t1928 - | ^ -note: 't192' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: +note: 't23' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:593:71: - 4695 | t1320*t1483 - | ^ -Warning: 't1912' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:95: + 593 | t220 = 0.26666666666666666667e1_dp*t74/t21/t19*t216*t103 + | ^ +Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:460:92: - 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & - | ^ -note: 't1912' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: + 460 | t174, t179, t18, t183, t186, t187, t188, t19, t194, t196, t199, t2, t200, t202, t21, & + | ^ +note: 't21' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:584:46: - 4695 | t1320*t1483 - | ^ -Warning: 't1902' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:74: + 584 | t194 = 0.1333333333e1_dp*t2*t42 + | ^ +Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:460:75: - 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & - | ^ -note: 't1902' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: + 460 | t174, t179, t18, t183, t186, t187, t188, t19, t194, t196, t199, t2, t200, t202, t21, & + | ^ +note: 't2' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:653:103: - 5488 | + 0.4500000000e1_dp*t2009*t4744 - | ^ + 653 | t421 = REAL(2*t25*t41*my_ndrho, dp) - 0.1333333333e1_dp*REAL(t19, dp)*REAL(my_ndrho, dp) + | ^ Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:60: +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:460:53: - 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & - | ^ + 460 | t174, t179, t18, t183, t186, t187, t188, t19, t194, t196, t199, t2, t200, t202, t21, & + | ^ note: 't19' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5228:58: +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: - 5228 | t5666 = 0.1125000000e2_dp*t1302*t1892*t1410 - | ^ -Warning: 't1892' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:41: + 619 | t300 - 0.1111111111e0_dp*t115*t188) + | ^ +Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:460:24: - 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & - | ^ -note: 't1892' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3453:30: + 460 | t174, t179, t18, t183, t186, t187, t188, t19, t194, t196, t199, t2, t200, t202, t21, & + | ^ +note: 't18' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:597:59: - 3453 | t503 = t189*t67 - | ^ -Warning: 't189' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:27: + 597 | t231 = t14*t223*t225*lambda*t17*t87/0.3e1_dp + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:459:88: - 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & - | ^ -note: 't189' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4814:44: + 459 | t140, t141, t143, t145, t146, t15, t151, t153, t157, t16, t162, t165, t169, t17, t171, & + | ^ +note: 't17' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:571:29: - 4814 | + (2*t147*t1284*t672) - | ^ -Warning: 't1886' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:21: + 571 | t162 = t15*t76 + | ^ +Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:459:42: - 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & - | ^ -note: 't1886' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5481:36: + 459 | t140, t141, t143, t145, t146, t15, t151, t153, t157, t16, t162, t165, t169, t17, t171, & + | ^ +note: 't15' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: - 5481 | t5011 + t5001 - | ^ -Warning: 't1885' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3080:14: + 619 | t300 - 0.1111111111e0_dp*t115*t188) + | ^ +Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:49: - 3080 | t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, t1912, & - | ^ -note: 't1885' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5129:43: + 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & + | ^ +note: 't119' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:631:108: - 5129 | t5421 = t657*t1884*t59*t1975 + 631 | - t300 - 0.1111111111e0_dp*t115*t316) + | ^ +Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:43: + + 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & | ^ -Warning: 't1884' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3079:97: +note: 't118' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:643:132: - 3079 | t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, t1884, & - | ^ -note: 't1884' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: + 643 | my_ndrhoa, dp) - 0.2222222222e0_dp*t115*my_rhoa*t355)) + | ^ +Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:37: - 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 - | ^ -Warning: 't1875' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3079:76: + 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & + | ^ +note: 't115' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:643:132: - 3079 | t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, t1884, & - | ^ -note: 't1875' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3534:30: + 643 | my_ndrhoa, dp) - 0.2222222222e0_dp*t115*my_rhoa*t355)) + | ^ +Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:31: - 3534 | t707 = t187*t59 - | ^ -Warning: 't187' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3079:55: + 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & + | ^ +note: 't113' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:656:132: - 3079 | t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, t1884, & - | ^ -note: 't187' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5404:58: + 656 | + t18*t90*t421*d - REAL(2*t95*t96*my_rhob*t108*my_ndrho, dp)) + | ^ +Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:25: - 5404 | t6109 = 0.1666666667e0_dp*t1246*t1962*t1865 - | ^ -Warning: 't1865' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3079:42: + 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & + | ^ +note: 't108' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:599:66: - 3079 | t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, t1884, & - | ^ -note: 't1865' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4807:32: + 599 | t246 = 0.2e1_dp/0.3e1_dp*t14*t17*t216*t225*t67*t103 + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:458:13: - 4807 | t4498 = t56*t1843 - | ^ -Warning: 't1843' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:83: + 458 | t103, t106, t108, t113, t115, t118, t119, t124, t125, t128, t129, t132, t135, t138, t14, & + | ^ +note: 't103' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:619:103: - 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & - | ^ -note: 't1843' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5357:33: + 619 | t300 - 0.1111111111e0_dp*t115*t188) + | ^ +Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:457:84: - 5357 | t6006 = t719*t1838 - | ^ -Warning: 't1838' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:69: + 457 | REAL(KIND=dp) :: cf, my_ndrho, my_ndrhoa, my_ndrhob, my_rhoa, my_rhob, t1, t10, t100, t102, & + | ^ +note: 't10' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:560:43: - 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & - | ^ -note: 't1838' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4719:70: + 560 | t132 = 0.40e1_dp*t1*t129*t10 + | ^ +Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F:457:79: - 4719 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 - | ^ -Warning: 't1837' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:62: + 457 | REAL(KIND=dp) :: cf, my_ndrho, my_ndrhoa, my_ndrhob, my_rhoa, my_rhob, t1, t10, t100, t102, & + | ^ +note: 't1' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_lyp_adiabatic.mod' due to: xc_lyp_adiabatic.o /build/reproducible-path/cp2k-8.1/src/xc/xc_lyp_adiabatic.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_perdew86.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew86.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod kinds.mod xc_perdew_zunger.mod xc_functionals_utilities.mod xc_input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew86.F xc_perdew86.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:22:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_perdew86.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_perdew86.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_perdew86.mod' due to: xc_perdew86.o /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew86.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod kinds.mod xc_perdew_zunger.mod xc_functionals_utilities.mod xc_input_constants.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xbecke_roussel.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F xc_xbecke_roussel.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:22:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbecke_roussel.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbecke_roussel.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2472:31: - 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & - | ^ -note: 't1837' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5314:42: + 2472 | t305 = t99*t271*R*t302 + | ^ +Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2304:36: - 5314 | t5908 = t1836*t59*t177*t710 - | ^ -Warning: 't1836' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:55: + 2304 | t9, t91, t94, t97, t98, t99 + | ^ +note: 't99' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2578:28: - 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & - | ^ -note: 't1836' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: + 2578 | t614 = t43*t612*t98 + | ^ +Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2304:31: - 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 - | ^ -Warning: 't183' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:34: + 2304 | t9, t91, t94, t97, t98, t99 + | ^ +note: 't98' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2572:34: - 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & + 2572 | + t36*t37/0.4e1_dp | ^ -note: 't183' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5276:40: - - 5276 | t5797 = t1373*t1962*t1829 - | ^ -Warning: 't1829' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:28: - - 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & - | ^ -note: 't1829' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5122:57: - - 5122 | t5400 = 0.3333333334e0_dp*t445*t1962*t1825 - | ^ -Warning: 't1825' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3078:14: +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2304:11: - 3078 | t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, t1852, & - | ^ -note: 't1825' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4747:29: + 2304 | t9, t91, t94, t97, t98, t99 + | ^ +note: 't9' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2477:24: - 4747 | *t3382 - | ^ -Warning: 't1821' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:81: + 2477 | t318 = t123*t81 + | ^ +Warning: 't81' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:81: - 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & + 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & | ^ -note: 't1821' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: - - 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 - | ^ -Warning: 't182' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:74: - - 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & - | ^ -note: 't182' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: - - 4737 | *t478*t183*t3918 - | ^ -Warning: 't1811' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:54: - - 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & - | ^ -note: 't1811' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5280:58: +note: 't81' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2479:28: - 5280 | t5810 = 0.1080000000e3_dp*t1143*t1801*t1410 - | ^ -Warning: 't1801' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:26: + 2479 | t330 = t179*t80*t98 + | ^ +Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:76: - 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & - | ^ -note: 't1801' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5481:36: + 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & + | ^ +note: 't80' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2572:34: - 5481 | t5011 + t5001 - | ^ -Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3077:12: + 2572 | + t36*t37/0.4e1_dp + | ^ +Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:71: - 3077 | t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, t1824, & - | ^ -note: 't18' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5332:52: + 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & + | ^ +note: 't8' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2435:25: - 5332 | t5949 = 0.8999999998e1_dp*t1795*t4909 - | ^ -Warning: 't1795' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:90: + 2435 | t215 = t76*gamma + | ^ +Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:62: - 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & - | ^ -note: 't1795' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5340:34: + 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & + | ^ +note: 't76' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2542:24: - 5340 | t5966 = t1785*t1790 - | ^ -Warning: 't1790' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:76: + 2542 | t504 = t74*t227 + | ^ +Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:57: - 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & - | ^ -note: 't1790' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5340:34: + 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & + | ^ +note: 't74' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2434:22: - 5340 | t5966 = t1785*t1790 - | ^ -Warning: 't1785' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:55: + 2434 | t213 = t7*t54 + | ^ +Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2303:37: - 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & - | ^ -note: 't1785' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5387:51: + 2303 | REAL(KIND=dp) :: t679, t682, t7, t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, & + | ^ +note: 't7' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2430:25: - 5387 | t6078 = 0.1111111112e0_dp*t719*t1782 - | ^ -Warning: 't1782' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:41: + 2430 | t205 = t66*gamma + | ^ +Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2302:58: - 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & - | ^ -note: 't1782' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5356:38: + 2302 | t630, t64, t643, t645, t65, t650, t653, t656, t66, t662, t67, t678 + | ^ +note: 't66' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2440:32: - 5356 | t6004 = t1709*t178*t710 - | ^ -Warning: 't178' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:34: + 2440 | t227 = 0.1e1_dp/t65/t29 + | ^ +Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2302:35: - 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & - | ^ -note: 't178' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5358:52: + 2302 | t630, t64, t643, t645, t65, t650, t653, t656, t66, t662, t67, t678 + | ^ +note: 't65' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2540:23: - 5358 | t6009 = 0.5000000001e0_dp*t1777*t4908 - | ^ -Warning: 't1777' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3076:21: + 2540 | t500 = t64*t76 + | ^ +Warning: 't64' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2302:18: - 3076 | t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, t1797, & - | ^ -note: 't1777' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5350:52: + 2302 | t630, t64, t643, t645, t65, t650, t653, t656, t66, t662, t67, t678 + | ^ +note: 't64' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2439:22: - 5350 | t5985 = 0.5000000001e0_dp*t1774*t4908 - | ^ -Warning: 't1774' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:96: + 2439 | t224 = t6*t63 + | ^ +Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2301:96: - 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & + 2301 | t57, t574, t575, t578, t58, t597, t598, t6, t600, t61, t612, t614, t615, t62, t627, t63, & | ^ -note: 't1774' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3535:31: - - 3535 | t708 = t707*t177 - | ^ -Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:82: - - 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & - | ^ -note: 't177' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5308:33: +note: 't63' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2412:22: - 5308 | t5885 = t719*t1769 - | ^ -Warning: 't1769' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:76: + 2412 | t161 = t6*rho + | ^ +Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2301:51: - 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & - | ^ -note: 't1769' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5382:40: + 2301 | t57, t574, t575, t578, t58, t597, t598, t6, t600, t61, t612, t614, t615, t62, t627, t63, & + | ^ +note: 't6' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2413:25: - 5382 | t6060 = t1766*t5881*t4940 - | ^ -Warning: 't1766' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:62: + 2413 | t163 = t57*gamma + | ^ +Warning: 't57' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2301:12: - 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & - | ^ -note: 't1766' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5375:52: + 2301 | t57, t574, t575, t578, t58, t597, t598, t6, t600, t61, t612, t614, t615, t62, t627, t63, & + | ^ +note: 't57' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2538:23: - 5375 | t6044 = 0.2000000002e1_dp*t1763*t5956 - | ^ -Warning: 't1763' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:48: + 2538 | t496 = t55*t66 + | ^ +Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2300:81: - 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & - | ^ -note: 't1763' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3722:30: + 2300 | t508, t510, t511, t52, t523, t526, t53, t539, t54, t541, t546, t549, t55, t552, t558, & + | ^ +note: 't55' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2437:26: - 3722 | t1140 = t176**2 - | ^ -Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3075:27: + 2437 | t220 = t6*t54*t27 + | ^ +Warning: 't54' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2300:58: - 3075 | REAL(kind=dp) :: t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, t1774, & - | ^ -note: 't176' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: + 2300 | t508, t510, t511, t52, t523, t526, t53, t539, t54, t541, t546, t549, t55, t552, t558, & + | ^ +note: 't54' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2425:22: - 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 - | ^ -Warning: 't1755' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3074:56: + 2425 | t187 = t7*t45 + | ^ +Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2298:69: - 3074 | t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757, t1758 - | ^ -note: 't1755' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5369:72: + 2298 | t413, t42, t426, t428, t43, t433, t436, t439, t44, t445, t45, t46, t461, t462, t465, & + | ^ +note: 't45' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2475:21: - 5369 | *t6021 + t6025 - 0.5555555558e-1_dp*t58*t5613*t71 - | ^ -Warning: 't1748' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3074:35: + 2475 | t310 = R*t43 + | ^ +Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2298:35: - 3074 | t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757, t1758 + 2298 | t413, t42, t426, t428, t43, t433, t436, t439, t44, t445, t45, t46, t461, t462, t465, & | ^ -note: 't1748' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: - - 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 - | ^ -Warning: 't1745' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3074:28: +note: 't43' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2420:28: - 3074 | t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757, t1758 + 2420 | t179 = 0.1e1_dp/t41 | ^ -note: 't1745' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5334:52: +Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2297:87: - 5334 | t5954 = 0.8999999998e1_dp*t1741*t4909 - | ^ -Warning: 't1741' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3074:14: + 2297 | t365, t366, t368, t37, t371, t375, t379, t383, t387, t390, t392, t393, t4, t41, t410, & + | ^ +note: 't41' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2533:31: - 3074 | t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757, t1758 - | ^ -note: 't1741' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5326:57: + 2533 | - t36*t37*gamma + | ^ +Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2297:30: - 5326 | t5929 = 0.2250000000e2_dp*t1740*t471*t4905 - | ^ -Warning: 't1740' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:97: + 2297 | t365, t366, t368, t37, t371, t375, t379, t383, t387, t390, t392, t393, t4, t41, t410, & + | ^ +note: 't37' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2533:31: - 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & + 2533 | - t36*t37*gamma + | ^ +Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2296:97: + + 2296 | REAL(KIND=dp) :: t318, t319, t330, t333, t336, t337, t340, t348, t35, t353, t356, t357, t36, & | ^ -note: 't1740' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: +note: 't36' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2409:28: - 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 - | ^ -Warning: 't1737' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:90: + 2409 | t154 = 0.1e1_dp/t35 + | ^ +Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2296:74: - 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & - | ^ -note: 't1737' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4775:32: + 2296 | REAL(KIND=dp) :: t318, t319, t330, t333, t336, t337, t340, t348, t35, t353, t356, t357, t36, & + | ^ +note: 't35' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2427:25: - 4775 | t4352 = t1731*t67 + 2427 | t192 = t30*gamma + | ^ +Warning: 't30' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2295:39: + + 2295 | t287, t29, t292, t294, t3, t30, t302, t305, t308, t31, t310, t315 + | ^ +note: 't30' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2440:32: + + 2440 | t227 = 0.1e1_dp/t65/t29 | ^ -Warning: 't1731' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:76: +Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2295:18: - 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & - | ^ -note: 't1731' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5360:52: + 2295 | t287, t29, t292, t294, t3, t30, t302, t305, t308, t31, t310, t315 + | ^ +note: 't29' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2536:23: - 5360 | t6019 = 0.7407407410e-1_dp*t719*t1726 - | ^ -Warning: 't1726' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:55: + 2536 | t492 = t28*t57 + | ^ +Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2294:80: - 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & - | ^ -note: 't1726' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5392:37: + 2294 | t237, t238, t24, t25, t26, t264, t267, t27, t270, t271, t274, t275, t28, t280, t285, & + | ^ +note: 't28' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2437:26: - 5392 | *t6075 - t6078 - | ^ -Warning: 't1722' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:41: + 2437 | t220 = t6*t54*t27 + | ^ +Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2294:51: - 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & - | ^ -note: 't1722' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5383:52: + 2294 | t237, t238, t24, t25, t26, t264, t267, t27, t270, t271, t274, t275, t28, t280, t285, & + | ^ +note: 't27' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2471:42: - 5383 | t6063 = 0.1000000000e1_dp*t1720*t5956 - | ^ -Warning: 't1720' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:34: + 2471 | *t110*t275 - t109*t112/t26 + | ^ +Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2294:34: - 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & + 2294 | t237, t238, t24, t25, t26, t264, t267, t27, t270, t271, t274, t275, t28, t280, t285, & | ^ -note: 't1720' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3554:70: +note: 't26' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2419:49: - 3554 | *t165*t462*t561 + 0.3333333334e0_dp*t55*t57*t735 - | ^ -Warning: 't172' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:27: + 2419 | *t4*t144*t19 - t175*t151/0.8e1_dp + | ^ +Warning: 't20' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2292:75: - 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & - | ^ -note: 't172' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5312:56: + 2292 | t179, t180, t182, t184, t185, t187, t19, t190, t192, t193, t2, t20, t201, t205, t206, & + | ^ +note: 't20' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2419:49: - 5312 | t5902 = 0.1800000000e2_dp*t1718*t178*t710 - | ^ -Warning: 't1718' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3073:14: + 2419 | *t4*t144*t19 - t175*t151/0.8e1_dp + | ^ +Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2292:48: - 3073 | t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, t1737, t1740, & - | ^ -note: 't1718' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5339:34: + 2292 | t179, t180, t182, t184, t185, t187, t19, t190, t192, t193, t2, t20, t201, t205, t206, & + | ^ +note: 't19' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2601:66: - 5339 | t5964 = t1715*t1525 - | ^ -Warning: 't1715' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:89: + 2601 | *t271*t650/0.24e2_dp)*sx + | ^ +Warning: 't138' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:37: - 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & - | ^ -note: 't1715' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: + 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & + | ^ +note: 't138' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2490:76: - 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 - | ^ -Warning: 't1712' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:75: + 2490 | *t337*t138/0.8e1_dp - t348*t271*t302/0.24e2_dp)*sx + | ^ +Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:31: - 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & - | ^ -note: 't1712' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3479:26: + 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & + | ^ +note: 't136' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2490:76: - 3479 | t537 - | ^ -Warning: 't171' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:68: + 2490 | *t337*t138/0.8e1_dp - t348*t271*t302/0.24e2_dp)*sx + | ^ +Warning: 't134' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:25: - 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & - | ^ -note: 't171' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5356:38: + 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & + | ^ +note: 't134' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2490:76: - 5356 | t6004 = t1709*t178*t710 - | ^ -Warning: 't1709' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:62: + 2490 | *t337*t138/0.8e1_dp - t348*t271*t302/0.24e2_dp)*sx + | ^ +Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:19: - 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & - | ^ -note: 't1709' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: + 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & + | ^ +note: 't133' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2599:36: - 4859 | *t83*t45*t3581*t140 + 2599 | - 0.4e1_dp*t679*t131 + | ^ +Warning: 't131' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2291:13: + + 2291 | t131, t133, t134, t136, t138, t144, t151, t154, t157, t158, t161, t163, t164, t175, t178, & + | ^ +note: 't131' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2471:42: + + 2471 | *t110*t275 - t109*t112/t26 | ^ -Warning: 't1706' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:48: +Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:89: - 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & - | ^ -note: 't1706' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4665:39: + 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & + | ^ +note: 't13' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2487:36: - 4665 | *t165*t3865*t237 - | ^ -Warning: 't1703' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:34: + 2487 | - 0.4e1_dp*t337*t131 + | ^ +Warning: 't128' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:84: - 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & - | ^ -note: 't1703' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: + 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & + | ^ +note: 't128' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2599:36: - 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 - | ^ -Warning: 't1700' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:20: + 2599 | - 0.4e1_dp*t679*t131 + | ^ +Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:78: - 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & - | ^ -note: 't1700' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5255:61: + 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & + | ^ +note: 't126' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2467:25: - 5255 | t5738 = 0.4444444445e0_dp*t170*t114*t4782*t451 - | ^ -Warning: 't170' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3072:13: + 2467 | t292 = t180*t125 + | ^ +Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:72: - 3072 | t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, t1715, t1717, & - | ^ -note: 't170' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3479:26: + 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & + | ^ +note: 't125' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2487:36: - 3479 | t537 - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:96: + 2487 | - 0.4e1_dp*t337*t131 + | ^ +Warning: 't124' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:66: - 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & - | ^ -note: 't17' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: + 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & + | ^ +note: 't124' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2487:36: - 4859 | *t83*t45*t3581*t140 - | ^ -Warning: 't1694' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:77: + 2487 | - 0.4e1_dp*t337*t131 + | ^ +Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:60: - 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & - | ^ -note: 't1694' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: + 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & + | ^ +note: 't123' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2591:28: - 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 - | ^ -Warning: 't1689' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:63: + 2591 | *t653)*t121 + | ^ +Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:54: - 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & - | ^ -note: 't1689' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5426:37: + 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & + | ^ +note: 't121' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2442:24: - 5426 | t6175 = t83*t597*t1688 - | ^ -Warning: 't1688' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:56: + 2442 | t229 = t228*t12 + | ^ +Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:48: - 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & - | ^ -note: 't1688' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5191:33: + 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & + | ^ +note: 't12' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2450:25: - 5191 | t5565 = t112*t1685 - | ^ -Warning: 't1685' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:49: + 2450 | t235 = t234*t118 + | ^ +Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:37: - 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & - | ^ -note: 't1685' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5175:43: + 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & + | ^ +note: 't118' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2599:36: - 5175 | t5528 = t102*t327*t1684*t557 - | ^ -Warning: 't1684' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:42: + 2599 | - 0.4e1_dp*t679*t131 + | ^ +Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:31: - 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & - | ^ -note: 't1684' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5164:38: + 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & + | ^ +note: 't117' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2487:36: - 5164 | t5496 = t366*t368*t1681 - | ^ -Warning: 't1681' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:35: + 2487 | - 0.4e1_dp*t337*t131 + | ^ +Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:25: - 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & - | ^ -note: 't1681' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5169:38: + 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & + | ^ +note: 't116' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2460:34: - 5169 | t5511 = t1680*t3673*t23 - | ^ -Warning: 't1680' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:28: + 2460 | t270 = 0.1e1_dp/t115/t114 + | ^ +Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:19: - 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & - | ^ -note: 't1680' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5163:49: + 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & + | ^ +note: 't115' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2460:34: - 5163 | t5494 = 0.6400000000e2_dp*t7*t1677 - | ^ -Warning: 't1677' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3071:14: + 2460 | t270 = 0.1e1_dp/t115/t114 + | ^ +Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2290:13: - 3071 | t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, t1699, t17, & - | ^ -note: 't1677' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5165:44: + 2290 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t126, t128, t13, t130, & + | ^ +note: 't114' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2471:42: - 5165 | t5499 = 0.120e2_dp*t550*t1669 - | ^ -Warning: 't1669' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:82: + 2471 | *t110*t275 - t109*t112/t26 + | ^ +Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:97: - 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & - | ^ -note: 't1669' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5167:52: + 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't112' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2588:26: - 5167 | t5507 = 0.120e2_dp*t7*t640*t1667*t371 - | ^ -Warning: 't1667' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:75: + 2588 | *t110*t275 + | ^ +Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:85: - 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & - | ^ -note: 't1667' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3479:26: + 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't110' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2588:26: - 3479 | t537 + 2588 | *t110*t275 | ^ -Warning: 't166' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:47: +Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:79: - 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & - | ^ -note: 't166' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5161:52: + 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't109' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2464:30: - 5161 | t5489 = 0.1600000000e2_dp*t1429*t1658 - | ^ -Warning: 't1658' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:41: + 2464 | t280 = t102*t103*t108 + | ^ +Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:73: - 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & - | ^ -note: 't1658' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5160:54: + 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't108' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2465:23: - 5160 | t5487 = 0.2160000000e3_dp*t7*t995*t1652 - | ^ -Warning: 't1652' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:20: + 2465 | t285 = t106**2 + | ^ +Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:67: - 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & - | ^ -note: 't1652' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5271:57: + 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't106' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2466:25: - 5271 | t5783 = 0.5555555557e-1_dp*t165*t5013*t433 - | ^ -Warning: 't165' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3070:13: + 2466 | t287 = t105/t285 + | ^ +Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:61: - 3070 | t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, t1675, & - | ^ -note: 't165' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4933:56: + 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't105' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2462:35: - 4933 | t102*t4838 - 0.20e1_dp*t102*t4850 - | ^ -Warning: 't1645' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:83: + 2462 | t274 = t101*t104*t108*t110 + | ^ +Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:55: - 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & - | ^ -note: 't1645' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5158:49: + 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't104' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2464:30: - 5158 | t5482 = 0.2160000000e3_dp*t7*t1642 + 2464 | t280 = t102*t103*t108 + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:49: + + 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & | ^ -Warning: 't1642' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:69: +note: 't103' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2464:30: - 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & - | ^ -note: 't1642' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: + 2464 | t280 = t102*t103*t108 + | ^ +Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:43: - 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 - | ^ -Warning: 't1640' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:62: + 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't102' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2462:35: - 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & - | ^ -note: 't1640' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3432:31: + 2462 | t274 = t101*t104*t108*t110 + | ^ +Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2289:37: - 3432 | t445 = t164*t444 - | ^ -Warning: 't164' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:55: + 2289 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't101' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2118:33: - 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & - | ^ -note: 't164' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5177:44: + 2118 | t301 = t99*t299/0.3e1_dp + | ^ +Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:95: - 5177 | t5533 = 0.160e2_dp*t112*t1632 - | ^ -Warning: 't1632' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:28: + 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 + | ^ +note: 't99' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2231:28: - 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & + 2231 | t614 = t43*t612*t98 | ^ -note: 't1632' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: +Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:90: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't1631' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3069:21: + 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 + | ^ +note: 't98' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2225:34: - 3069 | t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, t1649, & - | ^ -note: 't1631' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5176:44: + 2225 | + t36*t37/0.4e1_dp + | ^ +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:70: - 5176 | t5531 = 0.160e2_dp*t112*t1626 - | ^ -Warning: 't1626' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:84: + 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 + | ^ +note: 't9' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2102:29: - 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & - | ^ -note: 't1626' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: + 2102 | t259 = t81*t231*t257 + | ^ +Warning: 't81' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:51: - 4629 | *t321*t953*t1625 - | ^ -Warning: 't1625' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:77: + 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 + | ^ +note: 't81' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2124:24: - 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & - | ^ -note: 't1625' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5179:44: + 2124 | t312 = t80*t231 + | ^ +Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:46: - 5179 | t5537 = 0.160e2_dp*t112*t1622 - | ^ -Warning: 't1622' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:63: + 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 + | ^ +note: 't80' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2225:34: - 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & - | ^ -note: 't1622' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: + 2225 | + t36*t37/0.4e1_dp + | ^ +Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:41: - 4629 | *t321*t953*t1625 - | ^ -Warning: 't1621' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:56: + 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 + | ^ +note: 't8' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2080:25: - 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & - | ^ -note: 't1621' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5142:47: + 2080 | t211 = t76*gamma + | ^ +Warning: 't76' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:32: - 5142 | t5446 = 0.480e2_dp*t24*t23*t1618 - | ^ -Warning: 't1618' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:42: + 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 + | ^ +note: 't76' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2192:24: - 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & - | ^ -note: 't1618' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: + 2192 | t502 = t74*t223 + | ^ +Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1953:27: - 4629 | *t321*t953*t1625 - | ^ -Warning: 't1617' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:35: + 1953 | t71, t72, t73, t74, t76, t77, t8, t80, t81, t82, t85, t88, t9, t91, t94, t97, t98, t99 + | ^ +note: 't74' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2079:22: - 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & - | ^ -note: 't1617' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: + 2079 | t209 = t7*t54 + | ^ +Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1952:94: - 4637 | *t339*t969 - | ^ -Warning: 't1616' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3068:28: + 1952 | REAL(KIND=dp) :: t65, t651, t653, t655, t658, t66, t660, t662, t67, t674, t677, t690, t7, & + | ^ +note: 't7' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2075:25: - 3068 | REAL(kind=dp) :: t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, t1628, & - | ^ -note: 't1616' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5174:51: + 2075 | t201 = t66*gamma + | ^ +Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1952:55: - 5174 | t5525 = 0.2133333334e2_dp*t339*t1611 - | ^ -Warning: 't1611' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:62: + 1952 | REAL(KIND=dp) :: t65, t651, t653, t655, t658, t66, t660, t662, t67, t674, t677, t690, t7, & + | ^ +note: 't66' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2085:32: - 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 - | ^ -note: 't1611' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4213:46: + 2085 | t223 = 0.1e1_dp/t65/t29 + | ^ +Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1952:26: - 4213 | - t1994 + t1997 - t2000 - | ^ -Warning: 't161' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:48: + 1952 | REAL(KIND=dp) :: t65, t651, t653, t655, t658, t66, t660, t662, t67, t674, t677, t690, t7, & + | ^ +note: 't65' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2190:23: - 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 - | ^ -note: 't161' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5155:51: + 2190 | t498 = t64*t76 + | ^ +Warning: 't64' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1951:70: - 5155 | t5474 = 0.4266666668e2_dp*t339*t1608 - | ^ -Warning: 't1608' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:42: + 1951 | t612, t614, t62, t625, t627, t629, t63, t630, t632, t633, t64, t649 + | ^ +note: 't64' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2084:22: - 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 - | ^ -note: 't1608' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5144:44: + 2084 | t220 = t6*t63 + | ^ +Warning: 't63' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1951:47: - 5144 | t5451 = 0.640e2_dp*t605*t1603 - | ^ -Warning: 't1603' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:21: + 1951 | t612, t614, t62, t625, t627, t629, t63, t630, t632, t633, t64, t649 + | ^ +note: 't63' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2059:22: - 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 - | ^ -note: 't1603' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: + 2059 | t162 = t6*rho + | ^ +Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1950:80: - 4603 | *t3339 - | ^ -Warning: 't1602' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3067:14: + 1950 | t547, t549, t55, t552, t554, t556, t568, t57, t571, t58, t584, t599, t6, t600, t601, t61, & + | ^ +note: 't6' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2060:25: - 3067 | t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613, t1615 - | ^ -note: 't1602' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3413:31: + 2060 | t164 = t57*gamma + | ^ +Warning: 't57' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1950:53: - 3413 | t394 = t393*t160 - | ^ -Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:88: + 1950 | t547, t549, t55, t552, t554, t556, t568, t57, t571, t58, t584, t599, t6, t600, t601, t61, & + | ^ +note: 't57' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2188:23: - 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & - | ^ -note: 't160' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3852:46: + 2188 | t494 = t55*t66 + | ^ +Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1950:24: - 3852 | t1439 = 0.1e1_dp/t787/t16*t1438 - | ^ -Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:82: + 1950 | t547, t549, t55, t552, t554, t556, t568, t57, t571, t58, t584, t599, t6, t600, t601, t61, & + | ^ +note: 't55' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2082:26: - 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & + 2082 | t216 = t6*t54*t27 + | ^ +Warning: 't54' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1949:82: + + 1949 | t502, t503, t506, t508, t519, t52, t521, t523, t524, t526, t527, t53, t54, t543, t545, & | ^ -note: 't16' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5185:49: +note: 't54' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2070:22: - 5185 | t5551 = 0.1280e3_dp*t24*t298*t1599 - | ^ -Warning: 't1599' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:77: + 2070 | t183 = t7*t45 + | ^ +Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1947:81: - 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & - | ^ -note: 't1599' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: + 1947 | t411, t412, t42, t428, t43, t430, t432, t434, t437, t439, t44, t441, t45, t453, t456, & + | ^ +note: 't45' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2094:28: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't1598' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:70: + 2094 | t230 = t43*t228*t98 + | ^ +Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1947:35: - 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & - | ^ -note: 't1598' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4643:70: + 1947 | t411, t412, t42, t428, t43, t430, t432, t434, t437, t439, t44, t441, t45, t453, t456, & + | ^ +note: 't43' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2067:28: - 4643 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't1597' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:63: + 2067 | t180 = 0.1e1_dp/t41 + | ^ +Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1946:93: - 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & - | ^ -note: 't1597' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5188:52: + 1946 | t365, t367, t37, t371, t375, t379, t383, t386, t388, t4, t404, t406, t408, t409, t41, & + | ^ +note: 't41' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2183:31: - 5188 | t5560 = 0.2346666666e3_dp*t1589*t1592 - | ^ -Warning: 't1592' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:42: + 2183 | - t36*t37*gamma + | ^ +Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1946:24: - 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & - | ^ -note: 't1592' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4637:33: + 1946 | t365, t367, t37, t371, t375, t379, t383, t386, t388, t4, t404, t406, t408, t409, t41, & + | ^ +note: 't37' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2183:31: - 4637 | *t339*t969 - | ^ -Warning: 't1589' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3066:28: + 2183 | - t36*t37*gamma + | ^ +Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1945:85: - 3066 | t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, t1601, & + 1945 | REAL(KIND=dp) :: t313, t321, t326, t329, t339, t343, t35, t351, t354, t355, t36, t363, t364, & + | ^ +note: 't36' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2056:28: + + 2056 | t155 = 0.1e1_dp/t35 | ^ -note: 't1589' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5146:46: +Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1945:62: - 5146 | t5456 = 0.1280e3_dp*t1582*t1426 - | ^ -Warning: 't1582' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:84: + 1945 | REAL(KIND=dp) :: t313, t321, t326, t329, t339, t343, t35, t351, t354, t355, t36, t363, t364, & + | ^ +note: 't35' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2072:25: - 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & - | ^ -note: 't1582' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4859:42: + 2072 | t188 = t30*gamma + | ^ +Warning: 't30' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1944:28: - 4859 | *t83*t45*t3581*t140 - | ^ -Warning: 't1575' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:56: + 1944 | t297, t299, t3, t30, t301, t303, t306, t307, t308, t31, t310, t312 + | ^ +note: 't30' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2085:32: - 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & - | ^ -note: 't1575' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5424:56: + 2085 | t223 = 0.1e1_dp/t65/t29 + | ^ +Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1943:93: - 5424 | t6170 = 0.3333333336e0_dp*t289*t597*t1571 - | ^ -Warning: 't1571' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:42: + 1943 | t26, t261, t262, t263, t265, t266, t269, t27, t272, t273, t278, t28, t283, t285, t29, & + | ^ +note: 't29' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2186:23: - 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & - | ^ -note: 't1571' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4665:39: + 2186 | t490 = t28*t57 + | ^ +Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1943:76: - 4665 | *t165*t3865*t237 - | ^ -Warning: 't1568' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:28: + 1943 | t26, t261, t262, t263, t265, t266, t269, t27, t272, t273, t278, t28, t283, t285, t29, & + | ^ +note: 't28' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2082:26: - 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & - | ^ -note: 't1568' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4665:39: + 2082 | t216 = t6*t54*t27 + | ^ +Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1943:53: - 4665 | *t165*t3865*t237 - | ^ -Warning: 't1565' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:21: + 1943 | t26, t261, t262, t263, t265, t266, t269, t27, t272, t273, t278, t28, t283, t285, t29, & + | ^ +note: 't27' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2116:42: - 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & - | ^ -note: 't1565' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5428:38: + 2116 | *t110*t273 - t109*t112/t26 + | ^ +Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1943:12: - 5428 | t6181 = t289*t1564*t593 - | ^ -Warning: 't1564' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3065:14: + 1943 | t26, t261, t262, t263, t265, t266, t269, t27, t272, t273, t278, t28, t283, t285, t29, & + | ^ +note: 't26' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2066:49: - 3065 | t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, t1584, & - | ^ -note: 't1564' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4405:65: + 2066 | *t4*t145*t19 - t176*t152/0.8e1_dp + | ^ +Warning: 't20' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1941:57: - 4405 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 - | ^ -Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:82: + 1941 | t182, t183, t186, t188, t189, t19, t197, t2, t20, t201, t202, t205, t206, t209, t211, & + | ^ +note: 't20' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2066:49: - 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & - | ^ -note: 't156' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5438:56: + 2066 | *t4*t145*t19 - t176*t152/0.8e1_dp + | ^ +Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1941:42: - 5438 | t6201 = 0.3333333336e0_dp*t289*t597*t1557 + 1941 | t182, t183, t186, t188, t189, t19, t197, t2, t20, t201, t202, t205, t206, t209, t211, & + | ^ +note: 't19' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2137:56: + + 2137 | - t139*t269*t297/0.24e2_dp)*sx | ^ -Warning: 't1557' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:76: +Warning: 't139' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1940:25: - 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & - | ^ -note: 't1557' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5429:56: + 1940 | t135, t138, t139, t145, t152, t155, t158, t159, t162, t164, t165, t176, t179, t180, t181, & + | ^ +note: 't139' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2137:56: - 5429 | t6185 = 0.3333333336e0_dp*t289*t597*t1553 + 2137 | - t139*t269*t297/0.24e2_dp)*sx | ^ -Warning: 't1553' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:62: +Warning: 't138' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1940:19: - 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & - | ^ -note: 't1553' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4393:39: + 1940 | t135, t138, t139, t145, t152, t155, t158, t159, t162, t164, t165, t176, t179, t180, t181, & + | ^ +note: 't138' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2135:25: - 4393 | *t400*t401*t2230 - | ^ -Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:48: + 2135 | /0.3e1_dp + | ^ +Warning: 't135' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1940:13: - 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & - | ^ -note: 't155' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4651:71: + 1940 | t135, t138, t139, t145, t152, t155, t158, t159, t162, t164, t165, t176, t179, t180, t181, & + | ^ +note: 't135' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2135:25: - 4651 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 - | ^ -Warning: 't1547' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:35: + 2135 | /0.3e1_dp + | ^ +Warning: 't134' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:95: - 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & - | ^ -note: 't1547' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't134' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2249:70: - 4851 | *t289*t294*t1553 - | ^ -Warning: 't1546' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3064:28: + 2249 | t674 = (-t601 - t614 + t627 - t629 - t630 + t633 + t653)*t132 + | ^ +Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:89: - 3064 | t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, t1563, & - | ^ -note: 't1546' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't132' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2116:42: - 4870 | t3869 + t4657 + t4696) - | ^ -Warning: 't1536' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:84: + 2116 | *t110*t273 - t109*t112/t26 + | ^ +Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:83: - 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & - | ^ -note: 't1536' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4936:42: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't13' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2256:25: - 4936 | t4864 = t217*t46*t1535*t561 - | ^ -Warning: 't1535' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:77: + 2256 | /0.3e1_dp + | ^ +Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:78: - 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & - | ^ -note: 't1535' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't129' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2135:25: - 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 - | ^ -Warning: 't1531' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:70: + 2135 | /0.3e1_dp + | ^ +Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:72: - 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & - | ^ -note: 't1531' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4964:52: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't125' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2069:25: - 4964 | t4932 = 0.5000000001e0_dp*t1528*t4908 - | ^ -Warning: 't1528' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:56: + 2069 | t182 = t181*t124 + | ^ +Warning: 't124' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:66: - 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & - | ^ -note: 't1528' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4972:33: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't124' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2135:25: - 4972 | t4952 = t719*t1525 - | ^ -Warning: 't1525' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:49: + 2135 | /0.3e1_dp + | ^ +Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:60: - 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & - | ^ -note: 't1525' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5384:42: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't123' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2245:69: - 5384 | t6066 = t1519*t705*t561*t65 - | ^ -Warning: 't1519' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:35: + 2245 | t655 = (t601 + t614 - t627 - t629 - t630 + t633 + t653)*t121 + | ^ +Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:54: - 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & - | ^ -note: 't1519' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5361:39: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't121' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2087:24: - 5361 | t6021 = t649*t1518*t1722 - | ^ -Warning: 't1518' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3063:28: + 2087 | t225 = t224*t12 + | ^ +Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:48: - 3063 | t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, t1541, & - | ^ -note: 't1518' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4962:52: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't12' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2104:25: - 4962 | t4925 = 0.5000000001e0_dp*t1513*t4908 - | ^ -Warning: 't1513' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:94: + 2104 | t262 = t230*t118 + | ^ +Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:37: - 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & - | ^ -note: 't1513' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't118' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2106:27: - 4755 | t192*t68*t4256*t65 - | ^ -Warning: 't1510' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:80: + 2106 | t265 = t117*R*t257 + | ^ +Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:31: - 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & - | ^ -note: 't1510' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4167:80: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't117' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2137:56: - 4167 | + t1482 + t1479 - t1489 + 0.3333333334e0_dp*t55*t57*t2042 - | ^ -Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:73: + 2137 | - t139*t269*t297/0.24e2_dp)*sx + | ^ +Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:25: - 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & - | ^ -note: 't151' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4956:52: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't116' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2108:45: - 4956 | t4911 = 0.8999999998e1_dp*t1507*t4909 - | ^ -Warning: 't1507' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:60: + 2108 | t269 = REAL(t100, KIND=dp)/t115/t114 + | ^ +Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:19: - 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & - | ^ -note: 't1507' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4953:57: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't115' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2108:45: - 4953 | t4907 = 0.2250000000e2_dp*t1506*t471*t4905 - | ^ -Warning: 't1506' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:53: + 2108 | t269 = REAL(t100, KIND=dp)/t115/t114 + | ^ +Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1939:13: - 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & - | ^ -note: 't1506' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5328:38: + 1939 | t114, t115, t116, t117, t118, t119, t12, t121, t123, t124, t125, t129, t13, t132, t134, & + | ^ +note: 't114' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2116:42: - 5328 | t5938 = t192*t728*t1505 - | ^ -Warning: 't1505' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:46: + 2116 | *t110*t273 - t109*t112/t26 + | ^ +Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:97: - 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & - | ^ -note: 't1505' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5378:37: + 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't112' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2242:26: - 5378 | t6052 = t1504*t561*t65 - | ^ -Warning: 't1504' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:39: + 2242 | *t110*t273 + | ^ +Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:85: - 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & - | ^ -note: 't1504' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4946:39: + 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't110' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2242:26: - 4946 | t4895 = t478*t1500*t4729 - | ^ -Warning: 't1500' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:25: + 2242 | *t110*t273 + | ^ +Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:79: - 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & - | ^ -note: 't1500' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4516:85: + 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't109' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2111:30: - 4516 | + t3288) - | ^ -Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3062:18: + 2111 | t278 = t102*t103*t108 + | ^ +Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:73: - 3062 | t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, t1513, & - | ^ -note: 't150' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4943:57: + 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't108' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2112:23: - 4943 | t4887 = 0.1800000000e2_dp*t473*t1493*t4729 - | ^ -Warning: 't1493' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3061:83: + 2112 | t283 = t106**2 + | ^ +Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:67: - 3061 | REAL(kind=dp) :: t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, t1498, & - | ^ -note: 't1493' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3342:31: + 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't106' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2113:25: - 3342 | t250 = t149*t249 - | ^ -Warning: 't149' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3061:69: + 2113 | t285 = t105/t283 + | ^ +Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:61: - 3061 | REAL(kind=dp) :: t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, t1498, & - | ^ -note: 't149' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5405:59: + 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't105' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2109:35: - 5405 | t6112 = 0.5555555556e-1_dp*t1246*t4553*t1483 - | ^ -Warning: 't1483' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3061:49: + 2109 | t272 = t101*t104*t108*t110 + | ^ +Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:55: - 3061 | REAL(kind=dp) :: t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, t1498, & - | ^ -note: 't1483' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: + 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't104' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2111:30: - 5005 | + t5032 + t5035 - | ^ -Warning: 't1471' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:74: + 2111 | t278 = t102*t103*t108 + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:49: - 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 - | ^ -note: 't1471' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4555:38: + 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't103' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2111:30: - 4555 | t165*t171*t3449 - | ^ -Warning: 't1470' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:67: + 2111 | t278 = t102*t103*t108 + | ^ +Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:43: - 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 - | ^ -note: 't1470' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: + 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't102' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:2109:35: - 5005 | + t5032 + t5035 - | ^ -Warning: 't1466' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:54: + 2109 | t272 = t101*t104*t108*t110 + | ^ +Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1938:37: - 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 - | ^ -note: 't1466' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5005:38: + 1938 | REAL(KIND=dp) :: t1, t100, t101, t102, t103, t104, t105, t106, t108, t109, t110, t111, t112, & + | ^ +note: 't101' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1666:33: - 5005 | + t5032 + t5035 - | ^ -Warning: 't1459' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:41: + 1666 | t232 = 0.1e1_dp/t100/t99 + | ^ +Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1527:22: - 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 - | ^ -note: 't1459' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5558:32: + 1527 | t96, t97, t99 + | ^ +note: 't99' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1722:46: - 5558 | t6557 = t1447*t59 - | ^ -Warning: 't1447' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3060:14: + 1722 | (-t385 - t341 + t387)*t95*t237 + | ^ +Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1527:17: - 3060 | t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470, t1471 - | ^ -note: 't1447' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5178:45: + 1527 | t96, t97, t99 + | ^ +note: 't97' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1802:88: - 5178 | t5535 = 0.640e2_dp*t1582*t1444 - | ^ -Warning: 't1444' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:97: + 1802 | - t580 + t618)*t95*t237 + | ^ +Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:95: - 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & - | ^ -note: 't1444' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5197:53: + 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & + | ^ +note: 't95' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1802:88: - 5197 | t5579 = 0.80e1_dp*t102*t327*t645*t1443 - | ^ -Warning: 't1443' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:90: + 1802 | - t580 + t618)*t95*t237 + | ^ +Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:90: - 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & + 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ -note: 't1443' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4927:59: +note: 't94' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1722:46: - 4927 | - 0.2400000000e2_dp*t786/t2492*t1058 - | ^ -Warning: 't1440' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:83: + 1722 | (-t385 - t341 + t387)*t95*t237 + | ^ +Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:85: - 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & - | ^ -note: 't1440' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4851:39: + 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & + | ^ +note: 't93' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1672:22: - 4851 | *t289*t294*t1553 - | ^ -Warning: 't144' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:76: + 1672 | t247 = t91**2 + | ^ +Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:80: - 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & - | ^ -note: 't144' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4614:34: + 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & + | ^ +note: 't91' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1673:24: - 4614 | t3679 = t2565*t1439 - | ^ -Warning: 't1439' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:70: + 1673 | t249 = t90/t247 + | ^ +Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:75: - 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & + 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & + | ^ +note: 't90' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1623:23: + + 1623 | t134 = t133*t9 + | ^ +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:70: + + 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ -note: 't1439' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5024:66: +note: 't9' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1668:23: - 5024 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + 1668 | t234 = t86*t89 + | ^ +Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:66: + + 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & | ^ -Warning: 't1438' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:63: +note: 't89' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1671:27: - 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & - | ^ -note: 't1438' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: + 1671 | t242 = t87*t88*t93 + | ^ +Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:61: - 4622 | *t786*t1034*t1681 - | ^ -Warning: 't1429' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:49: + 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & + | ^ +note: 't88' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1671:27: - 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & - | ^ -note: 't1429' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5146:46: + 1671 | t242 = t87*t88*t93 + | ^ +Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:56: - 5146 | t5456 = 0.1280e3_dp*t1582*t1426 - | ^ -Warning: 't1426' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:42: + 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & + | ^ +note: 't87' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1668:23: - 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & - | ^ -note: 't1426' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5156:55: + 1668 | t234 = t86*t89 + | ^ +Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:51: - 5156 | t5478 = 0.240e2_dp*t1616*t973*t645*t1425 - | ^ -Warning: 't1425' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:35: + 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & + | ^ +note: 't86' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1679:31: - 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & - | ^ -note: 't1425' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5151:51: + 1679 | t267 = t84*t233*R*t264 + | ^ +Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:41: - 5151 | t5468 = 0.2346666666e3_dp*t605*t1420 - | ^ -Warning: 't1420' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3059:28: + 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & + | ^ +note: 't84' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1789:28: - 3059 | t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, t1444, & + 1789 | t580 = t23*t578*t83 | ^ -note: 't1420' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: +Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1526:36: - 4870 | t3869 + t4657 + t4696) - | ^ -Warning: 't1411' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:94: + 1526 | REAL(KIND=dp) :: t79, t82, t83, t84, t85, t86, t87, t88, t89, t9, t90, t91, t93, t94, t95, & + | ^ +note: 't83' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1684:24: - 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & - | ^ -note: 't1411' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5416:58: + 1684 | t280 = t108*t66 + | ^ +Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1525:53: - 5416 | t6155 = 0.2500000000e0_dp*t1981*t4032*t1410 - | ^ -Warning: 't1410' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:87: + 1525 | t629, t638, t65, t654, t655, t656, t659, t66, t67, t70, t73, t76 + | ^ +note: 't66' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1814:57: - 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & - | ^ -note: 't1410' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3485:108: + 1814 | + t581 - t596 - t655 - 0.4e1_dp*t656*t116 + | ^ +Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1525:24: - 3485 | t46*t541))*sx - | ^ -Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:80: + 1525 | t629, t638, t65, t654, t655, t656, t659, t66, t67, t70, t73, t76 + | ^ +note: 't65' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1641:25: - 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & - | ^ -note: 't141' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4870:96: + 1641 | t177 = t61*gamma + | ^ +Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1524:50: - 4870 | t3869 + t4657 + t4696) - | ^ -Warning: 't1409' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:74: + 1524 | t58, t580, t581, t59, t593, t596, t6, t61, t612, t613, t614, t616, t618, t62, t623, t626, & + | ^ +note: 't61' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1795:21: - 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & - | ^ -note: 't1409' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3554:70: + 1795 | t612 = t3*t6 + | ^ +Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1524:45: - 3554 | *t165*t462*t561 + 0.3333333334e0_dp*t55*t57*t735 - | ^ -Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:46: + 1524 | t58, t580, t581, t59, t593, t596, t6, t61, t612, t613, t614, t616, t618, t62, t623, t626, & + | ^ +note: 't6' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1749:24: - 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & - | ^ -note: 't140' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4497:80: + 1749 | t462 = t59*t189 + | ^ +Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1524:29: - 4497 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 - | ^ -Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:40: + 1524 | t58, t580, t581, t59, t593, t596, t6, t61, t612, t613, t614, t616, t618, t62, t623, t626, & + | ^ +note: 't59' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1636:25: - 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & - | ^ -note: 't14' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5213:57: + 1636 | t167 = t51*gamma + | ^ +Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:90: - 5213 | t5622 = 0.1666666667e0_dp*t165*t1392*t4729 - | ^ -Warning: 't1392' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:21: + 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & + | ^ +note: 't51' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1646:32: - 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & - | ^ -note: 't1392' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4814:44: + 1646 | t189 = 0.1e1_dp/t50/t32 + | ^ +Warning: 't50' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:67: - 4814 | + (2*t147*t1284*t672) - | ^ -Warning: 't1388' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3058:14: + 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & + | ^ +note: 't50' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1640:22: - 3058 | t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, t1411, & - | ^ -note: 't1388' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: + 1640 | t175 = t5*t39 + | ^ +Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:62: - 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 - | ^ -Warning: 't1387' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:96: + 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & + | ^ +note: 't5' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1747:23: - 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & - | ^ -note: 't1387' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: + 1747 | t458 = t49*t61 + | ^ +Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:58: - 4806 | *t1246*t3244*t1483 - | ^ -Warning: 't1377' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:89: + 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & + | ^ +note: 't49' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1645:22: - 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & - | ^ -note: 't1377' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5138:39: + 1645 | t186 = t4*t48 + | ^ +Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1522:35: - 5138 | t5432 = t1373*t446*t5430 - | ^ -Warning: 't1373' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:82: + 1522 | t466, t468, t469, t47, t48, t481, t484, t487, t49, t5, t50, t501, t504, t506, t51, t511, & + | ^ +note: 't48' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1633:25: - 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & - | ^ -note: 't1373' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5031:34: + 1633 | t159 = t42*gamma + | ^ +Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1520:74: - 5031 | *t105*t5118 - | ^ -Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:68: + 1520 | t385, t387, t39, t392, t395, t398, t4, t40, t402, t404, t409, t42, t420, t427, t428, & + | ^ +note: 't42' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1745:23: - 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & - | ^ -note: 't137' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4555:38: + 1745 | t454 = t40*t51 + | ^ +Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1520:51: - 4555 | t165*t171*t3449 - | ^ -Warning: 't1368' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:62: + 1520 | t385, t387, t39, t392, t395, t398, t4, t40, t402, t404, t409, t42, t420, t427, t428, & + | ^ +note: 't40' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1632:22: - 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & - | ^ -note: 't1368' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4823:58: + 1632 | t157 = t4*rho + | ^ +Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1520:46: - 4823 | + 0.3333333334e0_dp*t165*t437*t1688 - | ^ -Warning: 't1360' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:48: + 1520 | t385, t387, t39, t392, t395, t398, t4, t40, t402, t404, t409, t42, t420, t427, t428, & + | ^ +note: 't4' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1643:26: - 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & - | ^ -note: 't1360' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3378:31: + 1643 | t182 = t4*t39*t30 + | ^ +Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1520:24: - 3378 | t328 = t136*t233 - | ^ -Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:41: + 1520 | t385, t387, t39, t392, t395, t398, t4, t40, t402, t404, t409, t42, t420, t427, t428, & + | ^ +note: 't39' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1622:25: - 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & - | ^ -note: 't136' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4798:66: + 1622 | t133 = t33*gamma + | ^ +Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1518:70: - 4798 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 - | ^ -Warning: 't1348' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:35: + 1518 | t302, t31, t310, t314, t315, t317, t318, t32, t324, t328, t33 + | ^ +note: 't33' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1646:32: - 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & - | ^ -note: 't1348' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4682:40: + 1646 | t189 = 0.1e1_dp/t50/t32 + | ^ +Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1518:53: - 4682 | *t400*t1333*t1410 - | ^ -Warning: 't1340' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:21: + 1518 | t302, t31, t310, t314, t315, t317, t318, t32, t324, t328, t33 + | ^ +note: 't32' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1743:23: - 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & - | ^ -note: 't1340' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5220:57: + 1743 | t450 = t31*t42 + | ^ +Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1518:18: - 5220 | t5641 = 0.1500000000e1_dp*t405*t1333*t4729 - | ^ -Warning: 't1333' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3057:14: + 1518 | t302, t31, t310, t314, t315, t317, t318, t32, t324, t328, t33 + | ^ +note: 't31' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1664:25: - 3057 | t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, t1387, & - | ^ -note: 't1333' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: + 1664 | t186*t191 + | ^ +Warning: 't30' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1517:97: - 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 - | ^ -Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:92: + 1517 | t264, t267, t27, t270, t272, t277, t28, t280, t281, t29, t292, t295, t298, t299, t3, t30, & + | ^ +note: 't30' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1630:22: - 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & - | ^ -note: 't133' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: + 1630 | t153 = t4*t29 + | ^ +Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1517:64: - 4695 | t1320*t1483 - | ^ -Warning: 't1320' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:86: + 1517 | t264, t267, t27, t270, t272, t277, t28, t280, t281, t29, t292, t295, t298, t299, t3, t30, & + | ^ +note: 't29' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1682:21: - 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & - | ^ -note: 't1320' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: + 1682 | t272 = R*t23 + | ^ +Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1516:29: - 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 - | ^ -Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:79: + 1516 | t22, t226, t229, t23, t232, t233, t234, t235, t237, t24, t242, t247, t249, t254, t256, & + | ^ +note: 't23' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1625:22: - 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & - | ^ -note: 't132' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4695:34: + 1625 | t138 = t21**2 + | ^ +Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1515:93: - 4695 | t1320*t1483 - | ^ -Warning: 't1316' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:73: + 1515 | t178, t18, t182, t183, t186, t189, t190, t191, t194, t196, t197, t199, t2, t200, t21, & + | ^ +note: 't21' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1620:22: - 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & - | ^ -note: 't1316' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4308:43: + 1620 | t128 = t5*t17 + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1514:71: - 4308 | t2565 = t126/t131/t1056/t130 - | ^ -Warning: 't131' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:66: + 1514 | t146, t153, t154, t157, t159, t16, t160, t163, t167, t168, t17, t171, t172, t175, t177, & + | ^ +note: 't17' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1816:66: - 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & + 1816 | *t233*t623/0.24e2_dp)*sx | ^ -note: 't131' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5231:57: - - 5231 | t5670 = 0.2250000000e1_dp*t400*t1309*t4729 - | ^ -Warning: 't1309' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:60: +Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:43: - 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & - | ^ -note: 't1309' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5235:57: + 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & + | ^ +note: 't123' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1697:76: - 5235 | t5679 = 0.1875000000e1_dp*t1302*t406*t5002 - | ^ -Warning: 't1302' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:53: + 1697 | *t299*t123/0.8e1_dp - t310*t233*t264/0.24e2_dp)*sx + | ^ +Warning: 't121' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:37: - 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & - | ^ -note: 't1302' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4672:33: + 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & + | ^ +note: 't121' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1697:76: - 4672 | t3939 = t1301*t245 - | ^ -Warning: 't1301' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:46: + 1697 | *t299*t123/0.8e1_dp - t310*t233*t264/0.24e2_dp)*sx + | ^ +Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:31: - 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & - | ^ -note: 't1301' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5488:54: + 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & + | ^ +note: 't119' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1697:76: - 5488 | + 0.4500000000e1_dp*t2009*t4744 - | ^ -Warning: 't1300' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:39: + 1697 | *t299*t123/0.8e1_dp - t310*t233*t264/0.24e2_dp)*sx + | ^ +Warning: 't118' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:25: - 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & - | ^ -note: 't1300' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4308:43: + 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & + | ^ +note: 't118' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1814:57: - 4308 | t2565 = t126/t131/t1056/t130 - | ^ -Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:32: + 1814 | + t581 - t596 - t655 - 0.4e1_dp*t656*t116 + | ^ +Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1513:19: - 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & - | ^ -note: 't130' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3580:44: + 1513 | t115, t116, t118, t119, t121, t123, t128, t131, t133, t134, t137, t138, t140, t141, t143, & + | ^ +note: 't116' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1694:36: - 3580 | t796 = 0.1e1_dp/t787/t13*t795 - | ^ -Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:26: + 1694 | - 0.4e1_dp*t299*t116 + | ^ +Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:96: - 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & - | ^ -note: 't13' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5136:57: + 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & + | ^ +note: 't113' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1814:57: - 5136 | t5429 = 0.1666666667e0_dp*t445*t1292*t5143 + 1814 | + t581 - t596 - t655 - 0.4e1_dp*t656*t116 | ^ -Warning: 't1292' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3056:21: +Warning: 't111' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:90: - 3056 | t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, t133, & - | ^ -note: 't1292' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4814:44: + 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & + | ^ +note: 't111' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1785:38: - 4814 | + (2*t147*t1284*t672) - | ^ -Warning: 't1284' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:96: + 1785 | t566 = t3*t443*t140*t110*t103 + | ^ +Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:84: - 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & - | ^ -note: 't1284' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4791:39: + 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & + | ^ +note: 't110' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1694:36: - 4791 | *t429*t1928*t290 - | ^ -Warning: 't1283' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:89: + 1694 | - 0.4e1_dp*t299*t116 + | ^ +Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:78: - 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & - | ^ -note: 't1283' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4833:71: + 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & + | ^ +note: 't109' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1694:36: + + 1694 | - 0.4e1_dp*t299*t116 + | ^ +Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:72: - 4833 | *t3507 - t3512)*t149*t160 - | ^ -Warning: 't1275' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:82: + 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & + | ^ +note: 't108' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1805:37: - 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & - | ^ -note: 't1275' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4798:66: + 1805 | /0.3e1_dp*t626)*t106 + | ^ +Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:66: - 4798 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 + 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & | ^ -Warning: 't1264' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:68: - - 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & - | ^ -note: 't1264' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: +note: 't106' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1785:38: - 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 - | ^ -Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:61: + 1785 | t566 = t3*t443*t140*t110*t103 + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:54: - 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & - | ^ -note: 't126' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5269:59: + 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & + | ^ +note: 't103' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1814:57: - 5269 | t5776 = 0.2777777778e-1_dp*t1246*t1247*t5009 - | ^ -Warning: 't1247' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:48: + 1814 | + t581 - t596 - t655 - 0.4e1_dp*t656*t116 + | ^ +Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:48: - 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & + 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & | ^ -note: 't1247' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5269:59: +note: 't102' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1771:25: - 5269 | t5776 = 0.2777777778e-1_dp*t1246*t1247*t5009 - | ^ -Warning: 't1246' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:41: + 1771 | t525 = t143*t101 + | ^ +Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:42: - 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & - | ^ -note: 't1246' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: + 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & + | ^ +note: 't101' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1666:33: - 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 - | ^ -Warning: 't1235' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:20: + 1666 | t232 = 0.1e1_dp/t100/t99 + | ^ +Warning: 't100' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:36: - 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & - | ^ -note: 't1235' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4439:76: + 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & + | ^ +note: 't100' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1678:86: - 4439 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 - | ^ -Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3055:13: + 1678 | t256)*t95*t237 - t94*t97/t29 + | ^ +Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1512:30: - 3055 | t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, t1284, & - | ^ -note: 't123' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: + 1512 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t111, t113, & + | ^ +note: 't10' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1328:43: - 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 - | ^ -Warning: 't1224' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:95: + 1328 | t231 = REAL(t85, KIND=dp)/t100/t99 + | ^ +Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:51: - 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & - | ^ -note: 't1224' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: + 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 + | ^ +note: 't99' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1384:50: - 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 - | ^ -Warning: 't1221' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:88: + 1384 | t94*(-t317 - t340 + t358)*t95*t235 + | ^ +Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:46: - 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & - | ^ -note: 't1221' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3391:81: + 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 + | ^ +note: 't97' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1466:88: - 3391 | t360 = 0.28e2_dp/0.3e1_dp*t122*t114 - 0.28e2_dp/0.3e1_dp*t356*t357 - | ^ -Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:81: + 1466 | - t587 + t600)*t95*t235 + | ^ +Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:36: - 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & - | ^ -note: 't122' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: + 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 + | ^ +note: 't95' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1466:88: - 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 - | ^ -Warning: 't1216' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:75: + 1466 | - t587 + t600)*t95*t235 + | ^ +Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:31: - 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & - | ^ -note: 't1216' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: + 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 + | ^ +note: 't94' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1384:50: - 4755 | t192*t68*t4256*t65 - | ^ -Warning: 't1213' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:68: + 1384 | t94*(-t317 - t340 + t358)*t95*t235 + | ^ +Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:26: - 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & - | ^ -note: 't1213' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: + 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 + | ^ +note: 't93' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1333:22: - 4726 | *t58*t3796*t71 - | ^ -Warning: 't1207' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:54: + 1333 | t245 = t91**2 + | ^ +Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:21: - 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & - | ^ -note: 't1207' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: + 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 + | ^ +note: 't91' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1334:24: - 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 - | ^ -Warning: 't1201' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:40: + 1334 | t247 = t90/t245 + | ^ +Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:16: - 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & - | ^ -note: 't1201' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: + 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 + | ^ +note: 't90' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1283:23: - 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 - | ^ -Warning: 't1200' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:33: + 1283 | t135 = t134*t9 + | ^ +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1189:11: - 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & - | ^ -note: 't1200' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4575:35: + 1189 | t9, t90, t91, t93, t94, t95, t96, t97, t99 + | ^ +note: 't9' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1329:23: - 4575 | t3546 = 0.1e1_dp/t12 - | ^ -Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3054:26: + 1329 | t232 = t86*t89 + | ^ +Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:97: - 3054 | REAL(kind=dp) :: t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, t1224, & - | ^ -note: 't12' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: + 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & + | ^ +note: 't89' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1332:27: - 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 - | ^ -Warning: 't1194' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:76: + 1332 | t240 = t87*t88*t93 + | ^ +Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:92: - 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 - | ^ -note: 't1194' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4712:66: + 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & + | ^ +note: 't88' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1332:27: - 4712 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 - | ^ -Warning: 't1193' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:69: + 1332 | t240 = t87*t88*t93 + | ^ +Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:87: - 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 - | ^ -note: 't1193' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: + 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & + | ^ +note: 't87' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1329:23: - 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 - | ^ -Warning: 't1192' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:62: + 1329 | t232 = t86*t89 + | ^ +Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:82: - 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 - | ^ -note: 't1192' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: + 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & + | ^ +note: 't86' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1339:33: - 4613 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:48: + 1339 | t263 = t84*t261/0.3e1_dp + | ^ +Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:72: - 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 - | ^ -note: 't119' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4782:66: + 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & + | ^ +note: 't84' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1455:28: - 4782 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 - | ^ -Warning: 't1189' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:42: + 1455 | t587 = t23*t585*t83 + | ^ +Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:67: - 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 - | ^ -note: 't1189' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4747:29: + 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & + | ^ +note: 't83' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1322:29: - 4747 | *t3382 + 1322 | t221 = t66*t193*t219 | ^ -Warning: 't1176' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:35: +Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1188:26: - 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 + 1188 | REAL(KIND=dp) :: t66, t67, t672, t70, t73, t76, t79, t82, t83, t84, t85, t86, t87, t88, t89, & + | ^ +note: 't66' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1394:35: + + 1394 | t414 = ndrho*t141*t65*t114 | ^ -note: 't1176' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: +Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1187:70: - 4806 | *t1246*t3244*t1483 - | ^ -Warning: 't1172' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:28: + 1187 | t609, t61, t62, t628, t630, t632, t634, t639, t641, t645, t65, t655 + | ^ +note: 't65' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1300:25: - 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 - | ^ -note: 't1172' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: + 1300 | t173 = t61*gamma + | ^ +Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1187:18: - 4806 | *t1246*t3244*t1483 - | ^ -Warning: 't1168' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:21: + 1187 | t609, t61, t62, t628, t630, t632, t634, t639, t641, t645, t65, t655 + | ^ +note: 't61' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1451:35: - 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 - | ^ -note: 't1168' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4737:39: + 1451 | t574 = t3*t6*t572/0.9e1_dp + | ^ +Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1186:73: - 4737 | *t478*t183*t3918 - | ^ -Warning: 't1161' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3053:14: + 1186 | t548, t56, t563, t57, t572, t574, t58, t585, t587, t59, t598, t6, t600, t605, t606, t608, & + | ^ +note: 't6' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1414:24: - 3053 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193, t1194 - | ^ -note: 't1161' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: + 1414 | t471 = t59*t185 + | ^ +Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1186:63: - 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 - | ^ -Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:95: + 1186 | t548, t56, t563, t57, t572, t574, t58, t585, t587, t59, t598, t6, t600, t605, t606, t608, & + | ^ +note: 't59' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1295:25: - 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't116' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4747:29: + 1295 | t163 = t51*gamma + | ^ +Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1185:27: - 4747 | *t3382 - | ^ -Warning: 't1157' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:89: + 1185 | t499, t5, t50, t51, t516, t518, t52, t520, t522, t525, t526, t527, t530, t532, t545, & + | ^ +note: 't51' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1305:32: - 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1157' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5300:57: + 1305 | t185 = 0.1e1_dp/t50/t32 + | ^ +Warning: 't50' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1185:22: - 5300 | t5864 = 0.1800000000e2_dp*t473*t1150*t4729 - | ^ -Warning: 't1150' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:82: + 1185 | t499, t5, t50, t51, t516, t518, t52, t520, t522, t525, t526, t527, t530, t532, t545, & + | ^ +note: 't50' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1359:22: - 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1150' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3959:50: + 1359 | t312 = t5*t33 + | ^ +Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1185:17: - 3959 | t1636 = 0.5600000000e2_dp*t624*t115 - | ^ -Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:75: + 1185 | t499, t5, t50, t51, t516, t518, t52, t520, t522, t525, t526, t527, t530, t532, t545, & + | ^ +note: 't5' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1412:23: - 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't115' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5277:57: + 1412 | t467 = t49*t61 + | ^ +Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1184:64: - 5277 | t5801 = 0.3600000000e2_dp*t1143*t479*t5002 - | ^ -Warning: 't1143' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:69: + 1184 | t467, t468, t47, t471, t472, t475, t477, t48, t488, t49, t490, t493, t494, t496, t497, & + | ^ +note: 't49' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1304:22: - 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1143' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4738:33: + 1304 | t182 = t4*t48 + | ^ +Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1184:53: - 4738 | t4230 = t1142*t262 - | ^ -Warning: 't1142' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:62: + 1184 | t467, t468, t47, t471, t472, t475, t477, t48, t488, t49, t490, t493, t494, t496, t497, & + | ^ +note: 't48' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1292:25: - 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1142' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5385:63: + 1292 | t155 = t42*gamma + | ^ +Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1183:18: - 5385 | t6074 = 0.8099999996e2_dp*t496*t4769*t1141*t4915 - | ^ -Warning: 't1141' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:55: + 1183 | t414, t42, t423, t426, t43, t434, t443, t450, t455, t456, t459, t46, t460, t463, t464, & + | ^ +note: 't42' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1410:23: - 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1141' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3391:81: + 1410 | t463 = t40*t51 + | ^ +Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1182:73: - 3391 | t360 = 0.28e2_dp/0.3e1_dp*t122*t114 - 0.28e2_dp/0.3e1_dp*t356*t357 - | ^ -Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:41: + 1182 | t367, t37, t38, t388, t39, t390, t392, t394, t397, t399, t4, t40, t403, t405, t409, t410, & + | ^ +note: 't40' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1291:22: - 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't114' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: + 1291 | t153 = t4*rho + | ^ +Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1182:68: - 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 - | ^ -Warning: 't1137' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:35: + 1182 | t367, t37, t38, t388, t39, t390, t392, t394, t397, t399, t4, t40, t403, t405, t409, t410, & + | ^ +note: 't4' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1302:26: - 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1137' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: + 1302 | t178 = t4*t39*t30 + | ^ +Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1182:34: - 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 - | ^ -Warning: 't1134' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:28: + 1182 | t367, t37, t38, t388, t39, t390, t392, t394, t397, t399, t4, t40, t403, t405, t409, t410, & + | ^ +note: 't39' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1282:25: - 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1134' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: + 1282 | t134 = t33*gamma + | ^ +Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1180:70: - 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 - | ^ -Warning: 't1129' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:21: + 1180 | t305, t31, t312, t314, t315, t317, t319, t32, t323, t327, t33 + | ^ +note: 't33' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1305:32: - 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1129' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: + 1305 | t185 = 0.1e1_dp/t50/t32 + | ^ +Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1180:53: - 4726 | *t58*t3796*t71 - | ^ -Warning: 't1126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3052:14: + 1180 | t305, t31, t312, t314, t315, t317, t319, t32, t323, t327, t33 + | ^ +note: 't32' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1408:23: - 3052 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1126' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: + 1408 | t459 = t31*t42 + | ^ +Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1180:18: - 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 - | ^ -Warning: 't1125' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:95: + 1180 | t305, t31, t312, t314, t315, t317, t319, t32, t323, t327, t33 + | ^ +note: 't31' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1321:25: - 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1125' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4762:66: + 1321 | t182*t187 + | ^ +Warning: 't30' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1179:91: - 4762 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 - | ^ -Warning: 't1122' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:88: + 1179 | t265, t268, t269, t27, t270, t272, t274, t275, t28, t283, t288, t29, t291, t3, t30, t301, & + | ^ +note: 't30' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1289:22: - 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1122' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5191:33: + 1289 | t149 = t4*t29 + | ^ +Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1179:76: - 5191 | t5565 = t112*t1685 - | ^ -Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:81: + 1179 | t265, t268, t269, t27, t270, t272, t274, t275, t28, t283, t288, t29, t291, t3, t30, t301, & + | ^ +note: 't29' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1314:28: - 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't112' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4768:67: + 1314 | t192 = t23*t190*t83 + | ^ +Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1178:30: - 4768 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 - | ^ -Warning: 't1119' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:75: + 1178 | t225, t227, t228, t23, t231, t232, t233, t235, t24, t240, t245, t247, t259, t261, t263, & + | ^ +note: 't23' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1285:22: - 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1119' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4726:37: + 1285 | t139 = t21**2 + | ^ +Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1177:63: - 4726 | *t58*t3796*t71 - | ^ -Warning: 't1111' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:68: + 1177 | t18, t182, t185, t186, t187, t190, t192, t193, t2, t21, t219, t22, t221, t223, t224, & + | ^ +note: 't21' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1280:22: - 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1111' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4774:64: + 1280 | t129 = t5*t17 + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1176:65: - 4774 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 - | ^ -Warning: 't1109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:61: + 1176 | t153, t155, t156, t159, t16, t163, t164, t167, t168, t17, t171, t173, t174, t178, t179, & + | ^ +note: 't17' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1358:56: - 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1109' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4712:66: + 1358 | - t124*t231*t259/0.24e2_dp)*sx + | ^ +Warning: 't124' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1175:31: - 4712 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 - | ^ -Warning: 't1106' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:54: + 1175 | t119, t120, t123, t124, t129, t132, t134, t135, t138, t139, t141, t142, t143, t149, t150, & + | ^ +note: 't124' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1358:56: - 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1106' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: + 1358 | - t124*t231*t259/0.24e2_dp)*sx + | ^ +Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1175:25: - 4755 | t192*t68*t4256*t65 - | ^ -Warning: 't1101' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:47: + 1175 | t119, t120, t123, t124, t129, t132, t134, t135, t138, t139, t141, t142, t143, t149, t150, & + | ^ +note: 't123' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1356:25: - 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1101' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: + 1356 | /0.3e1_dp + | ^ +Warning: 't120' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1175:19: - 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 - | ^ -Warning: 't1100' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:40: + 1175 | t119, t120, t123, t124, t129, t132, t134, t135, t138, t139, t141, t142, t143, t149, t150, & + | ^ +note: 't120' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1356:25: - 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1100' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3380:30: + 1356 | /0.3e1_dp + | ^ +Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1175:13: - 3380 | t332 = t11*t114 - | ^ -Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:33: + 1175 | t119, t120, t123, t124, t129, t132, t134, t135, t138, t139, t141, t142, t143, t149, t150, & + | ^ +note: 't119' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1473:70: - 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't11' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4755:41: + 1473 | t655 = (-t574 - t587 + t600 - t605 - t606 + t609 + t632)*t117 + | ^ +Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:96: - 4755 | t192*t68*t4256*t65 - | ^ -Warning: 't1097' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:21: + 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & + | ^ +note: 't117' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1479:54: - 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1097' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4842:60: + 1479 | *t114 - t301*t608 - t120*t630/0.3e1_dp + | ^ +Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:90: - 4842 | + 0.2500000000e0_dp*t1981*t2707*t1410 - | ^ -Warning: 't1093' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3051:14: + 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & + | ^ +note: 't114' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1356:25: - 3051 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1093' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4806:41: + 1356 | /0.3e1_dp + | ^ +Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:84: - 4806 | *t1246*t3244*t1483 - | ^ -Warning: 't1085' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:89: + 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & + | ^ +note: 't110' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1460:47: - 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't1085' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3512:42: + 1460 | t605 = t3*t450*t141*t109*t103/0.9e1_dp + | ^ +Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:78: - 3512 | t635 = -4*t108 + 4*t332*rho - | ^ + 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & + | ^ +note: 't109' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1356:25: + + 1356 | /0.3e1_dp + | ^ Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:75: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:72: - 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ + 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & + | ^ note: 't108' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5090:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1469:69: - 5090 | t5311 = 0.1666666668e0_dp*t289*t1071*t4701 - | ^ -Warning: 't1071' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:55: + 1469 | t634 = (t574 + t587 - t600 - t605 - t606 + t609 + t632)*t106 + | ^ +Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:66: - 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't1071' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3517:73: + 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & + | ^ +note: 't106' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1460:47: - 3517 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 - | ^ -Warning: 't107' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:48: + 1460 | t605 = t3*t450*t141*t109*t103/0.9e1_dp + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:54: - 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & + 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & + | ^ +note: 't103' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1326:27: + + 1326 | t227 = t102*R*t219 + | ^ +Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:48: + + 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & | ^ -note: 't107' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4825:33: +note: 't102' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1358:56: - 4825 | t4575 = t1067*t561 - | ^ -Warning: 't1067' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:35: + 1358 | - t124*t231*t259/0.24e2_dp)*sx + | ^ +Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:42: - 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't1067' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: + 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & + | ^ +note: 't101' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1328:43: - 4603 | *t3339 - | ^ -Warning: 't1064' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:28: + 1328 | t231 = REAL(t85, KIND=dp)/t100/t99 + | ^ +Warning: 't100' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:36: - 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't1064' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4629:39: + 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & + | ^ +note: 't100' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1337:86: - 4629 | *t321*t953*t1625 - | ^ -Warning: 't1063' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:21: + 1337 | t221)*t95*t235 - t94*t97/t29 + | ^ +Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1174:30: - 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't1063' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5497:40: + 1174 | REAL(KIND=dp) :: t1, t10, t100, t101, t102, t103, t104, t106, t108, t109, t110, t114, t117, & + | ^ +note: 't10' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:959:23: - 5497 | *t1054*t640*t3679 - | ^ -Warning: 't1060' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3050:14: + 959 | t204 = t203*t9 + | ^ +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: - 3050 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't1060' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4233:31: + 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx + | ^ +Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:941:24: - 4233 | t2204 = t10*t106 - | ^ -Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:95: + 941 | t160 = t85*t103 + | ^ +Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:952:25: - 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't106' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4927:59: + 952 | t190 = t81*gamma + | ^ +Warning: 't81' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1026:24: - 4927 | - 0.2400000000e2_dp*t786/t2492*t1058 - | ^ -Warning: 't1058' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:82: + 1026 | t399 = t79*t202 + | ^ +Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:947:25: - 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't1058' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5172:67: + 947 | t180 = t71*gamma + | ^ +Warning: 't71' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:957:32: - 5172 | *t5511 + 0.1200000000e3_dp*t1055*t2565*t4721 - | ^ -Warning: 't1055' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:68: + 957 | t202 = 0.1e1_dp/t70/t35 + | ^ +Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1024:23: - 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't1055' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5497:40: + 1024 | t395 = t69*t81 + | ^ +Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:956:22: - 5497 | *t1054*t640*t3679 - | ^ -Warning: 't1054' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:61: + 956 | t199 = t3*t68 + | ^ +Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:932:25: - 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't1054' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: + 932 | t142 = t62*gamma + | ^ +Warning: 't62' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1022:23: - 4622 | *t786*t1034*t1681 - | ^ -Warning: 't1050' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:54: + 1022 | t391 = t60*t71 + | ^ +Warning: 't60' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1043:32: - 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't1050' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3337:31: + 1043 | t42*t43/0.4e1_dp + | ^ +Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1007:58: - 3337 | t234 = t105*t233 - | ^ -Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:47: + 1007 | *t313 - 0.80e2_dp/0.729e3_dp*t99*t195*t317 + | ^ +Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1015:22: - 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't105' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: + 1015 | t376 = t5*t36 + | ^ +Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:976:22: - 4613 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't1046' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:41: + 976 | t245 = t49**2 + | ^ +Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:939:28: - 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't1046' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: + 939 | t158 = 0.1e1_dp/t47 + | ^ +Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1018:31: - 4613 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't1044' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:34: + 1018 | - t42*t43*gamma + | ^ +Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:934:23: - 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't1044' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3371:30: + 934 | t154 = t42*t23 + | ^ +Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:929:28: - 3371 | t316 = t97*t104 - | ^ -Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:20: + 929 | t134 = 0.1e1_dp/t41 + | ^ +Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:994:51: - 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't104' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: + 994 | ndrho/0.9e1_dp + t154*t285/0.4e1_dp + | ^ +Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:944:25: - 4622 | *t786*t1034*t1681 - | ^ -Warning: 't1036' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3049:14: + 944 | t167 = t36*gamma + | ^ +Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:957:32: - 3049 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't1036' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: + 957 | t202 = 0.1e1_dp/t70/t35 + | ^ +Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1020:23: - 4622 | *t786*t1034*t1681 + 1020 | t387 = t34*t62 + | ^ +Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:928:40: + + 928 | t131 = 0.1e1_dp/t4/t33*gamma*t9 | ^ -Warning: 't1034' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:96: +Warning: 't33' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:930:22: - 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1034' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: + 930 | t137 = t3*t32 + | ^ +Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: - 4622 | *t786*t1034*t1681 - | ^ -Warning: 't1030' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:82: + 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx + | ^ +Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:938:53: - 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1030' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3648:29: + 938 | t42*t23*t124*t16 - t154*t131/0.8e1_dp + | ^ +Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1043:32: - 3648 | t972 = t103**2 + 1043 | t42*t43/0.4e1_dp + | ^ +Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:977:29: + + 977 | t248 = t21*t106/t245 | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:75: +Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:974:21: - 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't103' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: + 974 | *t204 + | ^ +Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:942:22: - 4622 | *t786*t1034*t1681 - | ^ -Warning: 't1026' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:69: + 942 | t162 = t4*t17 + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:938:53: - 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1026' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: + 938 | t42*t23*t124*t16 - t154*t131/0.8e1_dp + | ^ +Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: - 4622 | *t786*t1034*t1681 - | ^ -Warning: 't1024' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:62: + 1058 | /0.2e1_dp))*sx + | ^ +Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: Warning: 't111' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: - 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1024' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: + 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx + | ^ +Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:978:25: - 4622 | *t786*t1034*t1681 - | ^ -Warning: 't1021' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:55: + 978 | t249 = t109*t102 + | ^ +Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:979:29: - 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1021' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:5175:43: + 979 | t255 = t21*t106*t108 + | ^ +Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: - 5175 | t5528 = t102*t327*t1684*t557 - | ^ -Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:48: + 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx + | ^ +Warning: 't107' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1058:72: - 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't102' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4536:32: + 1058 | /0.2e1_dp))*sx + | ^ +Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:1052:53: - 4536 | t12*t1058 - | ^ -Warning: 't1014' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:35: + 1052 | t487 = t459*t160 + t472*t103 - t86*t211*t484 + | ^ +Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:989:125: - 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1014' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: + 989 | *t237/0.2e1_dp - t86*t103*t265*t111/0.2e1_dp))*sx + | ^ +Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: - 4622 | *t786*t1034*t1681 - | ^ -Warning: 't1012' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:28: + 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx + | ^ +Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: Warning: 't96' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: - 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1012' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4622:40: + 729 | *t199/0.2e1_dp - t71*t88*t227*t96/0.2e1_dp))*sx + | ^ +Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: - 4622 | *t786*t1034*t1681 - | ^ -Warning: 't1008' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:21: + 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx + | ^ +Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:719:27: - 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1008' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4613:54: + 719 | t217 = t21*t91*t93 + | ^ +Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: - 4613 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't1004' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3048:14: + 729 | *t199/0.2e1_dp - t71*t88*t227*t96/0.2e1_dp))*sx + | ^ +Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: - 3048 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1004' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:4603:29: + 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx + | ^ +Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:699:23: - 4603 | *t3339 - | ^ -Warning: 't1000' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3047:84: + 699 | t166 = t165*t9 + | ^ +Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:792:24: - 3047 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, ndrho, rho, t1, t10, t1000, t1002, & - | ^ -note: 't1000' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3667:50: + 792 | t436 = t435*t88 + | ^ +Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: - 3667 | t1019 = 0.1e1_dp/t19/t1014*t787*t10 - | ^ -Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:3047:77: + 729 | *t199/0.2e1_dp - t71*t88*t227*t96/0.2e1_dp))*sx + | ^ +Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: Warning: 't71' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:731:24: - 3047 | REAL(kind=dp) :: Cx, epsilon_rho43, my_epsilon_rho, ndrho, rho, t1, t10, t1000, t1002, & - | ^ -note: 't10' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: + 731 | t249 = t120*t70 + | ^ +Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:692:25: - 1841 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't997' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:400:30: + 692 | t152 = t66*gamma + | ^ +Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:768:24: - 400 | t99, t991, t995, t997, xx - | ^ -note: 't997' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2388:54: + 768 | t361 = t64*t164 + | ^ +Warning: 't64' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:687:25: - 2388 | t5487 = 0.2160000000e3_dp*t7*t995*t1652 - | ^ -Warning: 't995' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:400:24: + 687 | t142 = t56*gamma + | ^ +Warning: 't56' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:697:32: - 400 | t99, t991, t995, t997, xx - | ^ -note: 't995' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: + 697 | t164 = 0.1e1_dp/t55/t37 + | ^ +Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:766:23: - 1841 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't991' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:400:18: + 766 | t357 = t54*t66 + | ^ +Warning: 't54' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:696:22: - 400 | t99, t991, t995, t997, xx - | ^ -note: 't991' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: + 696 | t161 = t3*t53 + | ^ +Warning: 't53' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:757:22: - 2259 | *t105*t5118 - | ^ -Warning: 't99' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:400:12: + 757 | t340 = t5*t38 + | ^ +Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:684:25: - 400 | t99, t991, t995, t997, xx - | ^ -note: 't99' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: + 684 | t134 = t47*gamma + | ^ +Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:764:23: - 1841 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't987' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:95: + 764 | t353 = t45*t56 + | ^ +Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:745:58: - 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & - | ^ -note: 't987' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: + 745 | *t267 - 0.80e2_dp/0.729e3_dp*t84*t157*t271 + | ^ +Warning: 't44' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:730:22: - 1831 | *t3339 - | ^ -Warning: 't984' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:89: + 730 | t246 = t4*t38 + | ^ +Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: - 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & - | ^ -note: 't984' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx + | ^ +Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:697:32: - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't980' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:77: + 697 | t164 = 0.1e1_dp/t55/t37 + | ^ +Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:762:23: - 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & - | ^ -note: 't980' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2418:50: + 762 | t349 = t36*t47 + | ^ +Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:694:26: - 2418 | t5564 = 0.1173333333e3_dp*t5060*t98 - | ^ -Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:71: + 694 | t157 = t3*t44*t35 + | ^ +Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:756:46: - 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & - | ^ -note: 't98' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: + 756 | /0.2e1_dp))*sx + | ^ +Warning: 't34' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:729:74: - 1865 | *t339*t969 - | ^ -Warning: 't976' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:60: + 729 | *t199/0.2e1_dp - t71*t88*t227*t96/0.2e1_dp))*sx + | ^ +Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:716:22: - 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & - | ^ -note: 't976' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: + 716 | t207 = t28**2 + | ^ +Warning: 't28' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:678:22: - 1857 | *t321*t953*t1625 - | ^ -Warning: 't974' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:48: + 678 | t118 = t26**2 + | ^ +Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: - 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & - | ^ -note: 't974' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: + 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx + | ^ +Warning: 't21' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:714:21: - 1865 | *t339*t969 - | ^ -Warning: 't973' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:42: + 714 | *t166 + | ^ +Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:673:22: - 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & - | ^ -note: 't973' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:738:30: + 673 | t108 = t4*t17 + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: - 738 | t627 = t97*t132 + 802 | + t71*t234*t448/0.2e1_dp - t71*t88*t471*t96/0.2e1_dp))*sx + | ^ +Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F:802:105: Warning: 't100' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xbecke_roussel.mod' due to: xc_xbecke_roussel.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke_roussel.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_libxc_wrap.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_libxc_wrap.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_libxc_wrap.F xc_libxc_wrap.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:22:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_libxc_wrap.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_libxc_wrap.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_libxc_wrap.mod' due to: xc_libxc_wrap.o /build/reproducible-path/cp2k-8.1/src/xc/xc_libxc_wrap.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_log_handling.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_libxc.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_libxc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod kinds.mod xc_libxc_wrap.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_libxc.F xc_libxc.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:22:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_libxc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_libxc.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_libxc.mod' due to: xc_libxc.o /build/reproducible-path/cp2k-8.1/src/xc/xc_libxc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod kinds.mod xc_libxc_wrap.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_ke_gga.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_ke_gga.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod mathconstants.mod kinds.mod cp_array_utils.mod xc_functionals_utilities.mod xc_input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_ke_gga.F xc_ke_gga.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:22:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_ke_gga.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_ke_gga.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_ke_gga.mod' due to: xc_ke_gga.o /build/reproducible-path/cp2k-8.1/src/xc/xc_ke_gga.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod mathconstants.mod kinds.mod cp_array_utils.mod xc_functionals_utilities.mod xc_input_constants.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_sr_lda.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_sr_lda.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.fypp xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod xc_functionals_utilities.mod xc_input_constants.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_sr_lda.F xc_sr_lda.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:22:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_sr_lda.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_sr_lda.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_sr_lda.mod' due to: xc_sr_lda.o /build/reproducible-path/cp2k-8.1/src/xc/xc_sr_lda.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew_wang.fypp xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod xc_functionals_utilities.mod xc_input_constants.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_vwn.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod kinds.mod xc_functionals_utilities.mod xc_input_constants.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F xc_vwn.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:22:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_vwn.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_vwn.F90 +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1476:30: + + 1476 | t288 = t287*t97 | ^ Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1272:35: - 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & - | ^ + 1272 | t945, t948, t957, t96, t97, t972, t979, t982, t984, t986, t993, t996, x0p + | ^ note: 't97' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1484:72: - 1865 | *t339*t969 - | ^ -Warning: 't969' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:25: + 1484 | t109*(t295*t96 + 0.3177280975e0_dp*t298*t284)*t122 + | ^ +Warning: 't96' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1272:30: - 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & - | ^ -note: 't969' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + 1272 | t945, t948, t957, t96, t97, t972, t979, t982, t984, t986, t993, t996, x0p + | ^ +note: 't96' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1508:56: - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't966' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:19: + 1508 | t55 + t93 + t127)*sc + | ^ +Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1271:85: - 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & - | ^ -note: 't966' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: + 1271 | t890, t891, t893, t896, t9, t90, t901, t903, t905, t906, t91, t914, t92, t93, t937, t942, & + | ^ +note: 't93' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1424:30: - 1831 | *t3339 - | ^ -Warning: 't963' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:399:13: + 1424 | t206 = t144*t92 + | ^ +Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1271:80: - 399 | t963, t966, t969, t97, t972, t973, t974, t975, t976, t979, t98, t980, t983, t984, t987, & - | ^ -note: 't963' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: + 1271 | t890, t891, t893, t896, t9, t90, t901, t903, t905, t906, t91, t914, t92, t93, t937, t942, & + | ^ +note: 't92' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1765:30: - 1865 | *t339*t969 - | ^ -Warning: 't962' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:92: + 1765 | t752 = t90*t751 + | ^ +Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1271:40: - 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & - | ^ -note: 't962' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: + 1271 | t890, t891, t893, t896, t9, t90, t901, t903, t905, t906, t91, t914, t92, t93, t937, t942, & + | ^ +note: 't90' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1769:29: - 1831 | *t3339 + 1769 | t757 = t89*t91 | ^ -Warning: 't959' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:86: +Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1270:92: - 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & - | ^ -note: 't959' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + 1270 | REAL(KIND=dp) :: t865, t866, t869, t870, t873, t874, t875, t878, t881, t884, t887, t89, & + | ^ +note: 't89' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1666:64: - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't955' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:74: + 1666 | *t583*t548)*t86)*t91 + | ^ +Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1269:59: - 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & - | ^ -note: 't955' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2429:56: + 1269 | t833, t834, t835, t84, t842, t851, t857, t859, t86, t862, t864 + | ^ +note: 't86' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2165:60: - 2429 | t5593 = 0.1066666667e2_dp*t321*t953*t5087 - | ^ -Warning: 't953' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:62: + 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 + | ^ +Warning: 't834' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1269:19: - 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & - | ^ -note: 't953' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: + 1269 | t833, t834, t835, t84, t842, t851, t857, t859, t86, t862, t864 + | ^ +note: 't834' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: - 1865 | *t339*t969 - | ^ -Warning: 't950' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:56: + 2249 | t2048)*t2)*sc + | ^ +Warning: 't833' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1269:13: - 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & - | ^ -note: 't950' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:611:38: + 1269 | t833, t834, t835, t84, t842, t851, t857, t859, t86, t862, t864 + | ^ +note: 't833' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2243:80: - 611 | t341 = 0.1e1_dp/t19/t95 - | ^ -Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:50: + 2243 | 0.3e1_dp*t1765 + 0.120e2_dp*t1858*t327 - 0.120e2_dp*t1776 + | ^ +Warning: 't832' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:97: - 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & - | ^ -note: 't95' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2435:56: + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + | ^ +note: 't832' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: - 2435 | t5607 = 0.5866666667e2_dp*t307*t949*t5069 - | ^ -Warning: 't949' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:45: + 2099 | + t842 - t1609 + | ^ +Warning: 't831' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:91: - 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & - | ^ -note: 't949' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + | ^ +note: 't831' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2165:60: - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't946' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:398:39: + 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 + | ^ +Warning: 't830' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:85: - 398 | REAL(KIND=dp) :: t942, t944, t946, t949, t95, t950, t953, t954, t955, t958, t959, t962, & - | ^ -note: 't946' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + | ^ +note: 't830' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: - 1857 | *t321*t953*t1625 - | ^ -Warning: 't941' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:76: + 2249 | t2048)*t2)*sc + | ^ +Warning: 't829' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:79: - 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 - | ^ -note: 't941' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1843:31: + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + | ^ +note: 't829' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2243:80: - 1843 | t3682 = t24*t940 - | ^ -Warning: 't940' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:70: + 2243 | 0.3e1_dp*t1765 + 0.120e2_dp*t1858*t327 - 0.120e2_dp*t1776 + | ^ +Warning: 't828' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:73: - 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 - | ^ -note: 't940' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1466:70: + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + | ^ +note: 't828' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: - 1466 | *t371 - 0.4266666668e2_dp*t2220/t1014/t94*t1058 - | ^ -Warning: 't94' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:64: + 2099 | + t842 - t1609 + | ^ +Warning: 't827' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:67: - 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 - | ^ -note: 't94' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + | ^ +note: 't827' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2165:60: - 1865 | *t339*t969 - | ^ -Warning: 't930' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:59: + 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 + | ^ +Warning: 't826' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:61: - 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 - | ^ -note: 't930' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2417:50: + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + | ^ +note: 't826' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: - 2417 | t5562 = 0.5866666667e2_dp*t93*t4820 - | ^ -Warning: 't93' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:53: + 2249 | t2048)*t2)*sc + | ^ +Warning: 't825' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:55: - 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 - | ^ -note: 't93' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + | ^ +note: 't825' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't929' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:48: + 2249 | t2048)*t2)*sc + | ^ +Warning: 't824' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:49: - 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 - | ^ -note: 't929' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1893:39: + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + | ^ +note: 't824' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: - 1893 | *t165*t3865*t237 - | ^ -Warning: 't922' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:30: + 2099 | + t842 - t1609 + | ^ +Warning: 't823' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:43: - 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 - | ^ -note: 't922' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:590:29: + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + | ^ +note: 't823' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2215:50: - 590 | t298 = t92*t97 - | ^ -Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:24: + 2215 | - t820 + t486 + t603 - t822 + | ^ +Warning: 't822' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:37: - 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 - | ^ -note: 't92' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + | ^ +note: 't822' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: - 2079 | *t289*t294*t1553 - | ^ -Warning: 't918' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:19: + 2249 | t2048)*t2)*sc + | ^ +Warning: 't821' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:31: - 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + | ^ +note: 't821' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2215:50: + + 2215 | - t820 + t486 + t603 - t822 + | ^ +Warning: 't820' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:25: + + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & + | ^ +note: 't820' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + + 2249 | t2048)*t2)*sc + | ^ +Warning: 't819' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:19: + + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ -note: 't918' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: +note: 't819' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: - 2087 | *t83*t45*t3581*t140 - | ^ -Warning: 't914' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:397:13: + 2099 | + t842 - t1609 + | ^ +Warning: 't818' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1268:13: - 397 | t914, t918, t92, t922, t923, t926, t929, t93, t930, t94, t940, t941 + 1268 | t818, t819, t820, t821, t822, t823, t824, t825, t826, t827, t828, t829, t830, t831, t832, & | ^ -note: 't914' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2026:66: +note: 't818' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2215:50: - 2026 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 - | ^ -Warning: 't907' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:94: + 2215 | - t820 + t486 + t603 - t822 + | ^ +Warning: 't817' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:94: - 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ -note: 't907' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: +note: 't817' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: - 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 - | ^ -Warning: 't906' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:88: + 2249 | t2048)*t2)*sc + | ^ +Warning: 't816' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:88: - 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ -note: 't906' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1189:39: - - 1189 | t1640 = 0.1e1_dp/t787/t9 - | ^ -Warning: 't9' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:76: +note: 't816' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: - 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & - | ^ -note: 't9' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2670:57: + 2249 | t2048)*t2)*sc + | ^ +Warning: 't815' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:82: - 2670 | t6216 = 0.8333333340e-1_dp*t429*t897*t4701 - | ^ -Warning: 't897' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:72: + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & + | ^ +note: 't815' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2175:32: - 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & - | ^ -note: 't897' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: + 2175 | t1832 = t814*t254 + | ^ +Warning: 't814' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:76: - 2098 | t3869 + t4657 + t4696) - | ^ -Warning: 't893' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:60: + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & + | ^ +note: 't814' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: - 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & - | ^ -note: 't893' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1947:70: + 2099 | + t842 - t1609 + | ^ +Warning: 't813' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:70: - 1947 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & | ^ -Warning: 't886' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:48: - - 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & - | ^ -note: 't886' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1947:70: +note: 't813' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: - 1947 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 - | ^ -Warning: 't882' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:42: + 2249 | t2048)*t2)*sc + | ^ +Warning: 't812' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:64: - 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & - | ^ -note: 't882' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:749:49: + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & + | ^ +note: 't812' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2177:32: - 749 | *t615 - 0.20e1_dp*t102*t646 - | ^ -Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:30: + 2177 | t1838 = t811*t202 + | ^ +Warning: 't811' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:58: - 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & - | ^ -note: 't88' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & + | ^ +note: 't811' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2193:32: - 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 - | ^ -Warning: 't878' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:25: + 2193 | t1891 = t808*t254 + | ^ +Warning: 't808' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:52: - 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & - | ^ -note: 't878' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & + | ^ +note: 't808' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2181:32: - 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 - | ^ -Warning: 't874' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:396:13: + 2181 | t1850 = t806*t254 + | ^ +Warning: 't806' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:46: - 396 | t874, t877, t878, t88, t881, t882, t886, t889, t893, t894, t897, t9, t905, t906, t907, & - | ^ -note: 't874' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & + | ^ +note: 't806' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2189:32: - 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 - | ^ -Warning: 't87' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:93: + 2189 | t1870 = t804*t254 + | ^ +Warning: 't804' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:40: - 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & - | ^ -note: 't87' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & + | ^ +note: 't804' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2194:32: - 1954 | *t58*t3796*t71 - | ^ -Warning: 't866' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:82: + 2194 | t1893 = t803*t305 + | ^ +Warning: 't803' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:34: - 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & - | ^ -note: 't866' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & + | ^ +note: 't803' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2183:32: - 1983 | t192*t68*t4256*t65 - | ^ -Warning: 't865' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:76: + 2183 | t1858 = t802*t142 + | ^ +Warning: 't802' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:28: - 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & - | ^ -note: 't865' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1940:66: + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & + | ^ +note: 't802' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1448:30: - 1940 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 - | ^ -Warning: 't864' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:70: + 1448 | t245 = t80*t225 + | ^ +Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:22: - 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & - | ^ -note: 't864' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & + | ^ +note: 't80' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1924:47: - 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 - | ^ -Warning: 't863' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:64: + 1924 | t1099 = t8**(-0.1666666667e1_dp) + | ^ +Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:17: - 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & - | ^ -note: 't863' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & + | ^ +note: 't8' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2225:34: - 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 - | ^ -Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:52: + 2225 | *t136*t1986 + | ^ +Warning: 't799' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1267:13: - 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & - | ^ -note: 't86' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1975:29: + 1267 | t799, t8, t80, t802, t803, t804, t806, t808, t811, t812, t813, t814, t815, t816, t817, & + | ^ +note: 't799' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2225:34: - 1975 | *t3382 - | ^ -Warning: 't859' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:47: + 2225 | *t136*t1986 + | ^ +Warning: 't796' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:97: - 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & - | ^ -note: 't859' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1787:56: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't796' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2243:80: - 1787 | t3497 = 0.2400000000e2_dp*t473*t852*t1483 - | ^ -Warning: 't852' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:29: + 2243 | 0.3e1_dp*t1765 + 0.120e2_dp*t1858*t327 - 0.120e2_dp*t1776 + | ^ +Warning: 't793' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:91: - 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & - | ^ -note: 't852' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1466:70: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't793' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2219:33: - 1466 | *t371 - 0.4266666668e2_dp*t2220/t1014/t94*t1058 - | ^ -Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:17: + 2219 | t1975 = t1697*t789 + | ^ +Warning: 't789' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:85: - 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & - | ^ -note: 't85' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:713:98: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't789' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: - 713 | t46*t541))*sx - | ^ -Warning: 't84' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:395:12: + 2249 | t2048)*t2)*sc + | ^ +Warning: 't784' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:73: - 395 | t84, t85, t851, t852, t855, t857, t859, t86, t862, t863, t864, t865, t866, t867, t87, & - | ^ -note: 't84' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2061:71: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't784' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2176:32: - 2061 | *t3507 - t3512)*t149*t160 - | ^ -Warning: 't833' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:94: + 2176 | t1836 = t732*t783 + | ^ +Warning: 't783' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:67: - 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & - | ^ -note: 't833' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2654:37: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't783' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: - 2654 | t6175 = t83*t597*t1688 - | ^ -Warning: 't83' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:88: + 2249 | t2048)*t2)*sc + | ^ +Warning: 't782' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:61: - 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & - | ^ -note: 't83' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1783:38: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't782' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2154:38: - 1783 | t165*t171*t3449 + 2154 | t1783 = 0.160e2_dp*t780 | ^ -Warning: 't827' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:83: +Warning: 't780' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:55: - 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & - | ^ -note: 't827' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1910:40: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't780' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2212:29: - 1910 | *t400*t1333*t1410 - | ^ -Warning: 't822' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:71: + 2212 | *t1776 + | ^ +Warning: 't779' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:49: - 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & - | ^ -note: 't822' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1783:38: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't779' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2212:29: - 1783 | t165*t171*t3449 - | ^ -Warning: 't815' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:65: + 2212 | *t1776 + | ^ +Warning: 't778' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:43: - 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & - | ^ -note: 't815' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't778' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2212:29: - 2098 | t3869 + t4657 + t4696) - | ^ -Warning: 't804' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:59: + 2212 | *t1776 + | ^ +Warning: 't777' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:37: - 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & - | ^ -note: 't804' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't777' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2155:39: - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't801' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:53: + 2155 | t1785 = 0.2400e2_dp*t774 + | ^ +Warning: 't774' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:31: - 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & - | ^ -note: 't801' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't774' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2202:58: - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't800' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:47: + 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 + | ^ +Warning: 't773' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:25: - 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & - | ^ -note: 't800' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:786:108: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't773' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2202:58: - 786 | *t83*t653 - 0.2222222224e0_dp*t144*t46*t739))*sx - | ^ -Warning: 't8' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:41: + 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 + | ^ +Warning: 't772' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:19: - 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & - | ^ -note: 't8' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1764:32: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't772' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2152:64: - 1764 | t12*t1058 - | ^ -Warning: 't797' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:394:37: + 2152 | *t125*t340*t309 + t1775 - 0.40e1_dp*t1776 + | ^ +Warning: 't771' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1266:13: - 394 | t790, t792, t795, t796, t797, t8, t800, t801, t804, t815, t822, t826, t827, t83, t833, & - | ^ -note: 't797' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:713:98: + 1266 | t771, t772, t773, t774, t777, t778, t779, t780, t782, t783, t784, t786, t789, t793, t796, & + | ^ +note: 't771' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2156:37: - 713 | t46*t541))*sx - | ^ -Warning: 't79' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:95: + 2156 | t1786 = 0.80e1_dp*t769 + | ^ +Warning: 't769' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:91: - 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & - | ^ -note: 't79' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2107:42: + 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & + | ^ +note: 't769' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2100:37: - 2107 | t4721 = 0.1e1_dp/t787*t2480 - | ^ -Warning: 't787' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:90: + 2100 | t1611 = 0.80e1_dp*t767 + | ^ +Warning: 't767' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:85: - 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & - | ^ -note: 't787' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2155:59: + 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & + | ^ +note: 't767' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2092:36: - 2155 | - 0.2400000000e2_dp*t786/t2492*t1058 - | ^ -Warning: 't786' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:84: + 2092 | t1603 = 0.2e1_dp*t766 + | ^ +Warning: 't766' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:79: - 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & - | ^ -note: 't786' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1764:32: + 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & + | ^ +note: 't766' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: - 1764 | t12*t1058 - | ^ -Warning: 't782' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:72: + 2249 | t2048)*t2)*sc + | ^ +Warning: 't764' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:73: - 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & - | ^ -note: 't782' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: + 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & + | ^ +note: 't764' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: - 1744 | + t3288) - | ^ -Warning: 't78' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:66: + 2249 | t2048)*t2)*sc + | ^ +Warning: 't762' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:61: - 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & - | ^ -note: 't78' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1898:32: + 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & + | ^ +note: 't762' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2096:38: - 1898 | t3925 = t777*t561 - | ^ -Warning: 't777' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:61: + 2096 | t1609 = 0.160e2_dp*t759 + | ^ +Warning: 't759' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:55: - 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & - | ^ -note: 't777' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: + 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & + | ^ +note: 't759' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2202:58: - 1831 | *t3339 - | ^ -Warning: 't773' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:49: + 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 + | ^ +Warning: 't758' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:49: - 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ -note: 't773' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: +note: 't758' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2188:64: - 1857 | *t321*t953*t1625 - | ^ -Warning: 't772' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:43: + 2188 | *t133*t90*t91*t789 + 0.80e1_dp*t1671*t327 + | ^ +Warning: 't757' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:43: - 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ -note: 't772' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: +note: 't757' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2138:52: - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't769' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:37: + 2138 | t1730 = 0.160e2_dp*t755*t756*t252*t91 + | ^ +Warning: 't756' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:37: - 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ -note: 't769' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1770:57: +note: 't756' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2188:64: - 1770 | *t102*t3363 - 0.20e1_dp*t102*t3379 - | ^ -Warning: 't766' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:31: + 2188 | *t133*t90*t91*t789 + 0.80e1_dp*t1671*t327 + | ^ +Warning: 't755' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:31: - 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ -note: 't766' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: +note: 't755' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2091:39: - 1841 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't764' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:19: + 2091 | t1602 = 0.2400e2_dp*t753 + | ^ +Warning: 't753' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:25: - 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & + | ^ +note: 't753' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2212:29: + + 2212 | *t1776 + | ^ +Warning: 't752' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:19: + + 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ -note: 't764' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: +note: 't752' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2146:49: - 2098 | t3869 + t4657 + t4696) - | ^ -Warning: 't754' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:393:13: + 2146 | t1768 = 0.2400e2_dp*t750*t253*t751 + | ^ +Warning: 't751' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1265:13: - 393 | t754, t764, t765, t766, t769, t772, t773, t776, t777, t78, t782, t785, t786, t787, t79, & + 1265 | t751, t752, t753, t755, t756, t757, t758, t759, t762, t763, t764, t766, t767, t769, t77, & | ^ -note: 't754' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: +note: 't751' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2202:58: - 2098 | t3869 + t4657 + t4696) - | ^ -Warning: 't753' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:95: + 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 + | ^ +Warning: 't750' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:94: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ -note: 't753' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2112:55: + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ +note: 't750' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1444:30: - 2112 | t4732 = 0.6666666672e0_dp*t747*t84*t4729 - | ^ -Warning: 't747' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:89: + 1444 | t239 = t75*t212 + | ^ +Warning: 't75' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:88: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ -note: 't747' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:661:32: + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ +note: 't75' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2095:37: - 661 | t446 = t74*my_rho - | ^ -Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:83: + 2095 | t1606 = 0.80e1_dp*t748 + | ^ +Warning: 't748' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:83: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & | ^ -note: 't74' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1219:31: +note: 't748' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2093:37: - 1219 | t1694 = t45*t739 - | ^ -Warning: 't739' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:78: + 2093 | t1604 = 0.80e1_dp*t746 + | ^ +Warning: 't746' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:77: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ -note: 't739' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2019:39: + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ +note: 't746' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2094:36: - 2019 | *t429*t1928*t290 - | ^ + 2094 | t1605 = 0.2e1_dp*t745 + | ^ +Warning: 't745' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:71: + + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ +note: 't745' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2143:41: + + 2143 | t1754 = 0.2e1_dp*t744*t254 + | ^ +Warning: 't744' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:65: + + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ +note: 't744' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2249:111: + + 2249 | t2048)*t2)*sc + | ^ +Warning: 't743' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:59: + + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ +note: 't743' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2153:36: + + 2153 | t1782 = 0.2e1_dp*t742 + | ^ +Warning: 't742' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:53: + + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ +note: 't742' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2144:41: + + 2144 | t1764 = 0.2e1_dp*t741*t202 + | ^ +Warning: 't741' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:47: + + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ +note: 't741' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2032:40: + + 2032 | t1469 = t74**(-0.40e1_dp) + | ^ +Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:41: + + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ +note: 't74' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2207:29: + + 2207 | *t1094 + | ^ Warning: 't735' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:72: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:36: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ note: 't735' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2607:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2103:42: - 2607 | t6053 = t732*t6052 - | ^ + 2103 | t1620 = 0.80e1_dp*t733*t254 + | ^ +Warning: 't733' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:30: + + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ +note: 't733' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2243:80: + + 2243 | 0.3e1_dp*t1765 + 0.120e2_dp*t1858*t327 - 0.120e2_dp*t1776 + | ^ Warning: 't732' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:24: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ note: 't732' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2572:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2118:42: - 2572 | t5977 = 0.1111111112e0_dp*t1755*t729 - | ^ + 2118 | t1666 = 0.80e1_dp*t730*t254 + | ^ +Warning: 't730' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:18: + + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ +note: 't730' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1666:64: + + 1666 | *t583*t548)*t86)*t91 + | ^ +Warning: 't73' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1264:12: + + 1264 | t73, t730, t732, t733, t735, t74, t741, t742, t743, t744, t745, t746, t748, t75, t750, & + | ^ +note: 't73' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2147:41: + + 2147 | t1775 = 0.2e1_dp*t729*t305 + | ^ Warning: 't729' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:60: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:93: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ + 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & + | ^ note: 't729' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1940:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2120:32: - 1940 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 - | ^ + 2120 | t1671 = t728*t142 + | ^ Warning: 't728' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:87: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ + 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & + | ^ note: 't728' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2614:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2173:33: - 2614 | t6075 = t723*t6052 + 2173 | *t725*t371 | ^ -Warning: 't723' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:48: +Warning: 't725' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:81: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ -note: 't723' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2785:54: + 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & + | ^ +note: 't725' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2173:33: - 2785 | + t5949 + t5952 + t5954 - t5958 - | ^ + 2173 | *t725*t371 + | ^ Warning: 't722' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:75: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ + 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & + | ^ note: 't722' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2585:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2173:33: - 2585 | t6006 = t719*t1838 + 2173 | *t725*t371 | ^ Warning: 't719' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:36: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:69: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ + 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & + | ^ note: 't719' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2293:90: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2173:33: - 2293 | t729 - 0.5555555558e-1_dp*t192*t5271 - 0.5000000001e0_dp*t732*t4908 - | ^ + 2173 | *t725*t371 + | ^ Warning: 't716' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:63: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ + 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & + | ^ note: 't716' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1231:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1841:35: - 1231 | t1715 = t713*t67 - | ^ -Warning: 't713' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:24: + 1841 | t857 = 0.3e1_dp*t705 + | ^ +Warning: 't705' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:33: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ -note: 't713' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1277:51: + 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & + | ^ +note: 't705' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2129:32: - 1277 | t1797 = 0.8999999998e1_dp*t1795*t710 - | ^ -Warning: 't710' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:18: + 2129 | t1696 = t316*t704 + | ^ +Warning: 't704' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1263:27: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ -note: 't710' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:777:87: + 1263 | REAL(KIND=dp) :: t704, t705, t706, t709, t712, t715, t716, t719, t722, t725, t728, t729, & + | ^ +note: 't704' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: - 777 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 - | ^ -Warning: 't71' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:392:12: + 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + | ^ +Warning: 't697' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:66: - 392 | t71, t710, t713, t716, t719, t722, t723, t728, t729, t732, t735, t739, t74, t747, t753, & - | ^ -note: 't71' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1268:51: + 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 + | ^ +note: 't697' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: - 1268 | t1779 = 0.5000000001e0_dp*t1777*t709 - | ^ -Warning: 't709' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:93: + 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + | ^ +Warning: 't696' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:60: - 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & - | ^ -note: 't709' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2293:90: + 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 + | ^ +note: 't696' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: - 2293 | t729 - 0.5555555558e-1_dp*t192*t5271 - 0.5000000001e0_dp*t732*t4908 - | ^ -Warning: 't708' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:87: + 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + | ^ +Warning: 't691' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:54: - 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & - | ^ -note: 't708' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1425:33: + 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 + | ^ +note: 't691' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: - 1425 | t2114 = t707*t2113 - | ^ -Warning: 't707' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:81: + 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + | ^ +Warning: 't688' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:48: - 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & - | ^ -note: 't707' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2612:42: + 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 + | ^ +note: 't688' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: - 2612 | t6066 = t1519*t705*t561*t65 + 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + | ^ +Warning: 't687' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:42: + + 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 | ^ -Warning: 't705' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:75: +note: 't687' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: - 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & - | ^ -note: 't705' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: + 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + | ^ +Warning: 't683' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:36: - 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 - | ^ -Warning: 't70' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:69: + 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 + | ^ +note: 't683' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: - 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & - | ^ -note: 't70' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:602:29: + 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + | ^ +Warning: 't682' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:30: - 602 | t321 = t7*t219 - | ^ -Warning: 't7' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:64: + 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 + | ^ +note: 't682' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: - 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & - | ^ -note: 't7' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1679:30: + 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + | ^ +Warning: 't681' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:24: - 1679 | t3097 = t66*t69 - | ^ -Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:60: + 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 + | ^ +note: 't681' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: - 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & - | ^ -note: 't69' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1346:56: + 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + | ^ +Warning: 't679' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1262:13: - 1346 | t1952 = 0.5555555557e-1_dp*t165*t689*t433 - | ^ -Warning: 't689' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:55: + 1262 | t679, t68, t681, t682, t683, t687, t688, t691, t696, t697, t70 + | ^ +note: 't679' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: - 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & - | ^ -note: 't689' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:647:30: + 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + | ^ +Warning: 't678' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:96: - 647 | t406 = t68*t140 - | ^ -Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:49: + 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & + | ^ +note: 't678' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1971:47: - 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & - | ^ -note: 't68' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2135:73: + 1971 | *t674*t1171 - t291*t1181 + | ^ +Warning: 't674' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:90: - 2135 | *t165*t166*t4729 + 0.3333333334e0_dp*t55*t57*t4782 - | ^ -Warning: 't679' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:44: + 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & + | ^ +note: 't674' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1971:47: - 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & - | ^ -note: 't679' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: + 1971 | *t674*t1171 - t291*t1181 + | ^ +Warning: 't667' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:84: - 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) - | ^ -Warning: 't673' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:38: + 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & + | ^ +note: 't667' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1971:47: - 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & - | ^ -note: 't673' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2646:38: + 1971 | *t674*t1171 - t291*t1181 + | ^ +Warning: 't666' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:78: - 2646 | t6160 = t147*t1885*t672 - | ^ -Warning: 't672' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:391:32: + 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & + | ^ +note: 't666' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1960:32: - 391 | REAL(KIND=dp) :: t67, t672, t673, t679, t68, t689, t69, t7, t70, t705, t707, t708, t709, & + 1960 | t1238 = t874*t661 | ^ -note: 't672' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1367:55: - - 1367 | t1997 = 0.1666666667e0_dp*t165*t171*t668 - | ^ -Warning: 't668' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:390:76: +Warning: 't661' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:66: - 390 | t6603, t6611, t6620, t6621, t6630, t6640, t6658, t6665, t6669, t668 - | ^ -note: 't668' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:686:30: + 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & + | ^ +note: 't661' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1964:43: - 686 | t516 = t66*t515 - | ^ -Warning: 't66' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:389:92: + 1964 | t1252 = t865/t659/t282*t1250 + | ^ +Warning: 't659' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:60: - 389 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & - | ^ -note: 't66' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2642:38: + 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & + | ^ +note: 't659' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 2642 | t6141 = t658*t575*t1925 - | ^ + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ Warning: 't658' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:389:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:54: - 389 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & - | ^ + 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & + | ^ note: 't658' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1218:49: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 1218 | t1693 = 0.3333333336e0_dp*t55*t653 - | ^ -Warning: 't653' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:389:33: + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't657' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:48: - 389 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & - | ^ -note: 't653' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1131:49: + 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & + | ^ +note: 't657' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1961:30: - 1131 | t1545 = 0.3333333336e0_dp*t55*t650 - | ^ -Warning: 't650' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:389:13: + 1961 | t1244 = t654**2 + | ^ +Warning: 't654' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:36: - 389 | t650, t6509, t6529, t653, t6539, t6554, t6557, t6569, t657, t658, t6583, t6596, t66, & - | ^ -note: 't650' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:725:59: + 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & + | ^ +note: 't654' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1639:39: - 725 | *t71 - 0.5000000001e0_dp*t60*t561*t65 - | ^ + 1639 | t542 = 0.1e1_dp/t540/t65 + | ^ Warning: 't65' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:388:93: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:24: - 388 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & - | ^ + 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & + | ^ note: 't65' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1324:31: - - 1324 | t1902 = t68*t649 - | ^ -Warning: 't649' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:388:74: - - 388 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & - | ^ -note: 't649' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 2259 | *t105*t5118 - | ^ -Warning: 't646' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:388:54: + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't648' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1261:19: - 388 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & - | ^ -note: 't646' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2425:53: + 1261 | t645, t648, t65, t651, t654, t656, t657, t658, t659, t661, t662, t666, t667, t674, t678, & + | ^ +note: 't648' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 2425 | t5579 = 0.80e1_dp*t102*t327*t645*t1443 - | ^ -Warning: 't645' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:388:41: + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't644' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:96: - 388 | t6415, t6428, t6433, t6442, t645, t6451, t646, t6461, t6479, t649, t6490, t6499, t65, & - | ^ -note: 't645' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1397:32: + 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + | ^ +note: 't644' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 1397 | t2054 = t786*t640 - | ^ -Warning: 't640' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:387:88: + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't643' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:90: - 387 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & - | ^ -note: 't640' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: + 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + | ^ +note: 't643' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 - | ^ -Warning: 't637' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:387:47: + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't636' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:73: - 387 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & - | ^ -note: 't637' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: + 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + | ^ +note: 't636' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 - | ^ + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ Warning: 't635' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:387:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:67: - 387 | t6344, t635, t6352, t6363, t6367, t637, t6370, t6373, t6375, t6380, t6389, t640, t6400, & - | ^ + 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + | ^ note: 't635' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 - | ^ -Warning: 't628' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:386:40: + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't634' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:61: - 386 | t6267, t6268, t627, t6271, t628, t6281, t6283, t6290, t6291, t63, t6308, t6338, t6339, & - | ^ -note: 't628' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2385:51: + 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + | ^ +note: 't634' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 2385 | t5480 = 0.1760000000e3_dp*t5060*t627 - | ^ + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't631' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:55: + + 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + | ^ +note: 't631' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't630' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:49: + + 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + | ^ +note: 't630' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ Warning: 't627' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:386:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:43: - 386 | t6267, t6268, t627, t6271, t628, t6281, t6283, t6290, t6291, t63, t6308, t6338, t6339, & - | ^ + 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + | ^ note: 't627' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2428:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1953:63: - 2428 | t5590 = 0.80e1_dp*t624*t22*t326*t136*t233 - | ^ -Warning: 't624' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:385:41: + 1953 | *t622*t874 - 0.9531842928e0_dp*t266*t887 + | ^ +Warning: 't622' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:37: - 385 | t6219, t6222, t6223, t6227, t624, t6247, t6249, t6252, t6253, t6256, t6257, t6260, t6263, & - | ^ -note: 't624' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:678:35: + 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + | ^ +note: 't622' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1950:32: - 678 | *t61*t262*t25 - | ^ -Warning: 't62' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:384:61: + 1950 | t1168 = t619*t269 + | ^ +Warning: 't619' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:31: - 384 | REAL(KIND=dp) :: t6186, t6189, t6192, t6194, t6198, t62, t6201, t6207, t6210, t6213, t6216, & + 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + | ^ +note: 't619' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: + + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 | ^ -note: 't62' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: +Warning: 't618' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:25: - 2259 | *t105*t5118 - | ^ -Warning: 't615' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:382:96: + 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + | ^ +note: 't618' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 382 | t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & - | ^ -note: 't615' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1168:32: + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't617' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:19: - 1168 | t1608 = t953*t614 - | ^ -Warning: 't614' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:382:76: + 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + | ^ +note: 't617' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 382 | t6112, t6116, t6119, t6123, t6126, t6129, t6132, t6136, t6138, t614, t6141, t6144, t615, & - | ^ -note: 't614' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:573:34: + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't611' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1260:13: - 573 | t264 = t61*t262*t17 - | ^ -Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:381:73: + 1260 | t611, t617, t618, t619, t622, t627, t630, t631, t634, t635, t636, t64, t642, t643, t644, & + | ^ +note: 't611' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 381 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & - | ^ -note: 't61' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't610' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:93: - 2259 | *t105*t5118 - | ^ -Warning: 't609' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:381:40: + 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + | ^ +note: 't610' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1426:30: - 381 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & - | ^ -note: 't609' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1157:32: + 1426 | t208 = t149*t61 + | ^ +Warning: 't61' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:87: - 1157 | t1592 = t949*t608 + 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + | ^ +note: 't61' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1944:32: + + 1944 | t1151 = t607*t874 | ^ -Warning: 't608' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:381:27: +Warning: 't607' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:76: - 381 | t6078, t6079, t608, t6087, t609, t6090, t6091, t6094, t6099, t61, t6102, t6106, t6109, & - | ^ -note: 't608' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + | ^ +note: 't607' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 + 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 + | ^ +Warning: 't606' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:70: + + 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & | ^ +note: 't606' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2089:105: + + 2089 | t1599)*t2)*sc + | ^ Warning: 't605' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:380:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:64: - 380 | t6044, t6047, t6049, t605, t6052, t6053, t6056, t6058, t6060, t6063, t6066, t6074, t6075, & - | ^ + 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + | ^ note: 't605' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1265:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2137:80: - 1265 | t1774 = t60*t496 - | ^ + 2137 | + 0.2e1_dp*t1580 - 0.40e1_dp*t1582 + 0.80e1_dp*t1671*t257 + | ^ +Warning: 't604' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:58: + + 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + | ^ +note: 't604' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2215:50: + + 2215 | - t820 + t486 + t603 - t822 + | ^ +Warning: 't603' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:52: + + 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + | ^ +note: 't603' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: + + 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 + | ^ +Warning: 't602' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:46: + + 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + | ^ +note: 't602' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2102:42: + + 2102 | t1615 = 0.80e1_dp*t732*t601 + | ^ +Warning: 't601' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:40: + + 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + | ^ +note: 't601' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: + + 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 + | ^ +Warning: 't600' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:34: + + 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + | ^ +note: 't600' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1451:70: + + 1451 | t73*(t243*t60 + 0.3177280975e0_dp*t246*t232)*t86 + | ^ Warning: 't60' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:378:64: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:28: - 378 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & - | ^ + 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + | ^ note: 't60' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:621:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2089:105: - 621 | t365 = t6*my_ndrho - | ^ -Warning: 't6' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:378:59: + 2089 | t1599)*t2)*sc + | ^ +Warning: 't599' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:19: - 378 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & - | ^ -note: 't6' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1130:49: + 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + | ^ +note: 't599' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2137:80: - 1130 | t1543 = 0.3333333336e0_dp*t55*t598 - | ^ + 2137 | + 0.2e1_dp*t1580 - 0.40e1_dp*t1582 + 0.80e1_dp*t1671*t257 + | ^ Warning: 't598' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:378:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1259:13: - 378 | t5977, t5978, t598, t5985, t5990, t5994, t5996, t6, t60, t6000, t6002, t6004, t6006, & - | ^ + 1259 | t598, t599, t6, t60, t600, t601, t602, t603, t604, t605, t606, t607, t608, t61, t610, & + | ^ note: 't598' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2654:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2215:50: - 2654 | t6175 = t83*t597*t1688 - | ^ + 2215 | - t820 + t486 + t603 - t822 + | ^ Warning: 't597' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:377:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:96: - 377 | REAL(KIND=dp) :: t5954, t5956, t5958, t5960, t5963, t5964, t5966, t597, t5971, t5973, t5975, & - | ^ + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ note: 't597' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1363:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: - 1363 | t1987 = 0.8333333335e-1_dp*t429*t437*t593 - | ^ + 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 + | ^ +Warning: 't596' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:90: + + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ +note: 't596' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: + + 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 + | ^ +Warning: 't595' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:84: + + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ +note: 't595' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2089:105: + + 2089 | t1599)*t2)*sc + | ^ +Warning: 't594' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:78: + + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ +note: 't594' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: + + 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 + | ^ Warning: 't593' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:376:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:72: - 376 | t5929, t593, t5932, t5938, t5940, t5942, t5944, t5949, t5952 - | ^ + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ note: 't593' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1068:50: - - 1068 | t1408 = 0.4444444448e0_dp*t214*t590 - | ^ -Warning: 't590' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:375:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1840:35: - 375 | t5891, t5898, t59, t590, t5902, t5905, t5908, t5911, t5913, t5918, t5922, t5925, t5926, & - | ^ -note: 't590' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:762:30: + 1840 | t851 = 0.3e1_dp*t592 + | ^ +Warning: 't592' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:66: - 762 | t707 = t187*t59 - | ^ -Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:375:26: + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ +note: 't592' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2148:32: - 375 | t5891, t5898, t59, t590, t5902, t5905, t5908, t5911, t5913, t5918, t5922, t5925, t5926, & - | ^ -note: 't59' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2145:60: + 2148 | t1776 = t317*t591 + | ^ +Warning: 't591' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:60: - 2145 | t4812 = 0.1333333334e1_dp*t217*t46*t589*t1447 + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & | ^ -Warning: 't589' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:374:97: - - 374 | t5850, t5854, t5857, t5861, t5864, t5868, t5869, t5875, t5880, t5881, t5885, t5888, t589, & - | ^ -note: 't589' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1350:34: +note: 't591' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 1350 | t1962 = t585*my_rho - | ^ -Warning: 't585' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:373:97: + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ +Warning: 't583' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:54: - 373 | t5819, t5822, t5825, t5828, t5830, t5831, t5833, t5835, t5838, t5841, t5845, t5848, t585, & - | ^ -note: 't585' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:576:30: + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ +note: 't583' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 576 | t268 = t58*t237 - | ^ -Warning: 't58' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:372:53: + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ +Warning: 't582' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:48: - 372 | t5786, t5789, t579, t5792, t5795, t5797, t58, t5801, t5804, t5807, t5810, t5813, t5816, & - | ^ -note: 't58' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ +note: 't582' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 - | ^ -Warning: 't579' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:372:27: + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ +Warning: 't577' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:42: - 372 | t5786, t5789, t579, t5792, t5795, t5797, t58, t5801, t5804, t5807, t5810, t5813, t5816, & - | ^ -note: 't579' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1414:39: + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ +note: 't577' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 1414 | t2081*t575*t2082 - | ^ -Warning: 't575' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:371:34: + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ +Warning: 't574' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:36: - 371 | t5742, t5745, t5749, t575, t5752, t5756, t5760, t5767, t5770, t5773, t5776, t5780, t5783, & - | ^ -note: 't575' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:847:69: + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ +note: 't574' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 847 | *t170*t455*t17 + 0.3333333334e0_dp*t55*t57*t889 + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 | ^ +Warning: 't573' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:30: + + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ +note: 't573' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1454:30: + + 1454 | t255 = t57*t254 + | ^ Warning: 't57' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:369:67: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:24: - 369 | t5686, t5689, t569, t5692, t5695, t5696, t5698, t5699, t57, t5701, t5705 - | ^ + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ note: 't57' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2709:36: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 2709 | t5011 + t5001 - | ^ + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ Warning: 't569' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:369:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:19: - 369 | t5686, t5689, t569, t5692, t5695, t5696, t5698, t5699, t57, t5701, t5705 - | ^ + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ note: 't569' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2135:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 2135 | *t165*t166*t4729 + 0.3333333334e0_dp*t55*t57*t4782 - | ^ + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ +Warning: 't568' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1258:13: + + 1258 | t568, t569, t57, t573, t574, t577, t582, t583, t591, t592, t593, t594, t595, t596, t597, & + | ^ +note: 't568' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: + + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ Warning: 't567' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:368:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:95: - 368 | t5657, t566, t5660, t5663, t5666, t5667, t567, t5670, t5671, t5673, t5676, t5679, t5682, & - | ^ + 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + | ^ note: 't567' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1345:56: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 1345 | t1946 = 0.1666666667e0_dp*t165*t1392*t561 - | ^ -Warning: 't561' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:366:67: + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ +Warning: 't565' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:89: - 366 | t5593, t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, & - | ^ -note: 't561' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:673:30: + 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + | ^ +note: 't565' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 673 | t479 = t56*t140 + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ +Warning: 't564' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:83: + + 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + | ^ +note: 't564' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2031:47: + + 2031 | *t560*t1394 - t239*t1404 + | ^ +Warning: 't560' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:77: + + 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + | ^ +note: 't560' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1422:30: + + 1422 | t204 = t140*t56 | ^ Warning: 't56' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:366:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:71: - 366 | t5593, t5595, t5597, t56, t5600, t5602, t5604, t5607, t561, t5610, t5611, t5613, t5619, & - | ^ + 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + | ^ note: 't56' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2031:47: - 2259 | *t105*t5118 - | ^ -Warning: 't558' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:365:75: + 2031 | *t560*t1394 - t239*t1404 + | ^ +Warning: 't553' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:66: - 365 | t5562, t5564, t5565, t5568, t557, t5572, t5574, t5575, t5579, t558, t5581, t5585, t5590, & - | ^ -note: 't558' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2721:79: + 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + | ^ +note: 't553' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2031:47: - 2721 | *t327*t2057*t557 - t5456 + t5459 - t5462 + t5466 - t5468 - | ^ -Warning: 't557' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:365:41: + 2031 | *t560*t1394 - t239*t1404 + | ^ +Warning: 't552' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:60: - 365 | t5562, t5564, t5565, t5568, t557, t5572, t5574, t5575, t5579, t558, t5581, t5585, t5590, & - | ^ -note: 't557' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: + 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + | ^ +note: 't552' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1508:56: - 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 - | ^ -Warning: 't550' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:363:32: + 1508 | t55 + t93 + t127)*sc + | ^ +Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:54: - 363 | REAL(KIND=dp) :: t55, t550, t5503, t5507, t5509, t551, t5511, t5516, t5523, t5525, t5528, & + 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + | ^ +note: 't55' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2039:32: + + 2039 | t1510 = t874*t547 | ^ -note: 't550' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2312:55: +Warning: 't547' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:43: - 2312 | t5301 = 0.3333333336e0_dp*t55*t384*t4729 - | ^ -Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:363:26: + 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + | ^ +note: 't547' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2043:43: - 363 | REAL(KIND=dp) :: t55, t550, t5503, t5507, t5509, t551, t5511, t5516, t5523, t5525, t5528, & - | ^ -note: 't55' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:929:31: + 2043 | t1524 = t865/t545/t230*t1522 + | ^ +Warning: 't545' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:37: - 929 | t1071 = t45*t541 + 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + | ^ +note: 't545' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't544' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:31: + + 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & | ^ -Warning: 't541' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:359:90: +note: 't544' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: - 359 | t5373, t5376, t5379, t5383, t5386, t5389, t5397, t5400, t5402, t5406, t5409, t541, t5412, & - | ^ -note: 't541' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't543' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:25: - 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 - | ^ -Warning: 't537' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:358:83: + 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + | ^ +note: 't543' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2040:30: - 358 | t5342, t5343, t5345, t5347, t5351, t5354, t5357, t5360, t5363, t5367, t537, t5370, t5371, & - | ^ -note: 't537' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1678:69: + 2040 | t1516 = t540**2 + | ^ +Warning: 't540' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1257:13: - 1678 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 - | ^ -Warning: 't534' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:357:97: + 1257 | t540, t542, t543, t544, t545, t547, t548, t55, t552, t553, t56, t560, t564, t565, t567, & + | ^ +note: 't540' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1386:30: - 357 | t5311, t5314, t5317, t5320, t5323, t5326, t5329, t5330, t5333, t5335, t5338, t5339, t534, & - | ^ -note: 't534' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1691:34: + 1386 | t148 = t147*t54 + | ^ +Warning: 't54' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:92: - 1691 | *t503*t2312 - | ^ -Warning: 't531' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:356:94: + 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & + | ^ +note: 't54' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: - 356 | REAL(KIND=dp) :: t5291, t5294, t5295, t5298, t53, t530, t5301, t5303, t5305, t5308, t531, & - | ^ -note: 't531' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1691:34: + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't534' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:81: - 1691 | *t503*t2312 - | ^ + 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & + | ^ +note: 't534' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ Warning: 't530' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:356:60: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:69: - 356 | REAL(KIND=dp) :: t5291, t5294, t5295, t5298, t53, t530, t5301, t5303, t5305, t5308, t531, & - | ^ + 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & + | ^ note: 't530' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1242:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: - 1242 | t1735 = 0.3703703705e-1_dp*t719*t527 - | ^ -Warning: 't527' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:355:33: + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't529' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:63: - 355 | t5256, t526, t5262, t527, t5270, t5271, t5276, t5280, t5281, t5284 - | ^ -note: 't527' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1700:64: + 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & + | ^ +note: 't529' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: - 1700 | *t2622*t71 - 0.1666666668e0_dp*t1106*t886 - | ^ -Warning: 't526' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:355:20: + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't522' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:51: - 355 | t5256, t526, t5262, t527, t5270, t5271, t5276, t5280, t5281, t5284 - | ^ -note: 't526' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: + 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & + | ^ +note: 't522' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: - 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 - | ^ + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't521' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:45: + + 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & + | ^ +note: 't521' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ Warning: 't520' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:354:46: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:39: - 354 | t516, t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, & - | ^ + 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & + | ^ note: 't520' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: - 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 - | ^ + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ Warning: 't517' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:354:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:33: - 354 | t516, t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, & - | ^ + 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & + | ^ note: 't517' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: - 1954 | *t58*t3796*t71 - | ^ + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ Warning: 't516' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:354:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1256:27: - 354 | t516, t5163, t517, t5170, t5174, t520, t5226, t5228, t5229, t5237, t5244, t5247, t5251, & - | ^ + 1256 | REAL(KIND=dp) :: t516, t517, t520, t521, t522, t528, t529, t530, t531, t534, t537, t54, & + | ^ note: 't516' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: - 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 - | ^ -Warning: 't515' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:353:95: + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't513' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:70: - 353 | t5106, t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, & - | ^ -note: 't515' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1691:34: + 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + | ^ +note: 't513' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1601:54: - 1691 | *t503*t2312 - | ^ -Warning: 't512' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:353:47: + 1601 | t473*t435)*t51 + | ^ +Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:64: - 353 | t5106, t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, & + 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + | ^ +note: 't51' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2024:63: + + 2024 | *t508*t874 - 0.9531842928e0_dp*t214*t887 + | ^ +Warning: 't508' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:59: + + 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + | ^ +note: 't508' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2021:32: + + 2021 | t1391 = t505*t217 + | ^ +Warning: 't505' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:53: + + 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + | ^ +note: 't505' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't504' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:47: + + 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 | ^ -note: 't512' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:984:32: +note: 't504' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: - 984 | t1213 = t511*t225 + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't503' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:41: + + 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + | ^ +note: 't503' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1920:47: + + 1920 | t1088 = t5**(-0.1666666667e1_dp) + | ^ +Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:35: + + 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + | ^ +note: 't5' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't497' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:31: + + 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + | ^ +note: 't497' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't496' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:25: + + 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + | ^ +note: 't496' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2015:32: + + 2015 | t1374 = t493*t874 | ^ -Warning: 't511' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:353:27: +Warning: 't493' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1255:13: - 353 | t5106, t5108, t511, t5115, t5118, t512, t5122, t5123, t5126, t5139, t5143, t5147, t515, & - | ^ -note: 't511' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2608:52: + 1255 | t493, t494, t496, t497, t5, t503, t504, t505, t508, t51, t513 + | ^ +note: 't493' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2165:60: - 2608 | t6056 = 0.5555555558e-1_dp*t508*t5271 - | ^ -Warning: 't508' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:352:83: + 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 + | ^ +Warning: 't492' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:96: + + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + | ^ +note: 't492' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: + + 2099 | + t842 - t1609 + | ^ +Warning: 't491' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:90: + + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + | ^ +note: 't491' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: + + 2099 | + t842 - t1609 + | ^ +Warning: 't490' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:84: + + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + | ^ +note: 't490' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2089:105: + + 2089 | t1599)*t2)*sc + | ^ +Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:73: + + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + | ^ +note: 't489' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: + + 2099 | + t842 - t1609 + | ^ +Warning: 't488' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:67: - 352 | t5040, t5043, t5044, t5047, t5050, t5051, t5060, t5065, t5069, t5079, t508, t5083, t5087, & - | ^ -note: 't508' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + | ^ +note: 't488' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2089:105: - 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 - | ^ -Warning: 't503' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:351:76: + 2089 | t1599)*t2)*sc + | ^ +Warning: 't487' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:61: - 351 | t5009, t5011, t5013, t5016, t5019, t5022, t5025, t5028, t5029, t503, t5032, t5035, t5036, & - | ^ -note: 't503' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:940:31: + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + | ^ +note: 't487' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2215:50: - 940 | t1106 = t500*t67 - | ^ -Warning: 't500' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:350:65: + 2215 | - t820 + t486 + t603 - t822 + | ^ +Warning: 't486' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:55: - 350 | t4952, t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, & - | ^ -note: 't500' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1523:40: + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + | ^ +note: 't486' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: - 1523 | *t1368*t166*t2160 - | ^ -Warning: 't50' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:350:59: + 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 + | ^ +Warning: 't485' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:49: - 350 | t4952, t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, & - | ^ -note: 't50' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1678:69: + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + | ^ +note: 't485' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: - 1678 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 - | ^ -Warning: 't498' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:350:40: + 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 + | ^ +Warning: 't484' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:43: - 350 | t4952, t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, & - | ^ -note: 't498' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + | ^ +note: 't484' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2089:105: - 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 - | ^ -Warning: 't496' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:350:34: + 2089 | t1599)*t2)*sc + | ^ +Warning: 't483' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:37: - 350 | t4952, t4955, t4958, t496, t498, t4994, t4995, t50, t500, t5001, t5002, t5005, t5008, & - | ^ -note: 't496' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:569:30: + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + | ^ +note: 't483' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2159:79: - 569 | t245*t17 - | ^ -Warning: 't49' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:347:74: + 2159 | - t484 + t1785 + t1786 + 0.4e1_dp*t485 + 0.160e2_dp*t602 + | ^ +Warning: 't482' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:31: - 347 | t4881, t4884, t4887, t4889, t489, t4893, t4895, t4897, t4898, t49, t4901, t4904, t4905, & - | ^ -note: 't49' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + | ^ +note: 't482' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2072:32: - 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 - | ^ -Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:347:41: + 2072 | t1576 = t481*t254 + | ^ +Warning: 't481' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:25: - 347 | t4881, t4884, t4887, t4889, t489, t4893, t4895, t4897, t4898, t49, t4901, t4904, t4905, & - | ^ -note: 't489' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:586:38: + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + | ^ +note: 't481' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1839:35: - 586 | t289 = my_rho*t48*omega - | ^ -Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:345:19: + 1839 | t842 = 0.3e1_dp*t480 + | ^ +Warning: 't480' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:19: - 345 | t4797, t48, t4800, t4801, t4804, t4808, t4812, t4817, t4820, t4829, t4830, t4833, t4834, & + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & | ^ -note: 't48' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1658:33: +note: 't480' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2145:32: - 1658 | t1176*t804 - | ^ + 2145 | t1765 = t320*t479 + | ^ Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:344:75: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1254:13: - 344 | t4769, t4770, t4771, t4772, t4776, t478, t4782, t4786, t4789, t479, t4790, t4793, t4796, & - | ^ + 1254 | t479, t480, t481, t482, t483, t484, t485, t486, t487, t488, t489, t49, t490, t491, t492, & + | ^ note: 't479' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2174:39: - - 2174 | t4895 = t478*t1500*t4729 - | ^ -Warning: 't478' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:344:48: - - 344 | t4769, t4770, t4771, t4772, t4776, t478, t4782, t4786, t4789, t479, t4790, t4793, t4796, & - | ^ -note: 't478' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1658:33: - - 1658 | t1176*t804 - | ^ -Warning: 't474' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:343:55: - - 343 | t4732, t4733, t4734, t4736, t4738, t4739, t474, t4743, t4744, t4748, t4760, t4764, t4768, & - | ^ -note: 't474' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2697:45: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: - 2697 | *t4901 - t4907 + t4911 - | ^ + 1900 | *t45*t1020*t984*t1027 + | ^ Warning: 't473' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:342:95: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:96: - 342 | REAL(KIND=dp) :: t4708, t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, & - | ^ + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ note: 't473' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1286:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: - 1286 | t1821 = t472*t262 - | ^ + 1900 | *t45*t1020*t984*t1027 + | ^ Warning: 't472' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:342:61: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:90: - 342 | REAL(KIND=dp) :: t4708, t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, & - | ^ + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ note: 't472' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2778:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: - 2778 | *t6271 - | ^ -Warning: 't471' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:342:34: + 1900 | *t45*t1020*t984*t1027 + | ^ +Warning: 't467' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:84: - 342 | REAL(KIND=dp) :: t4708, t471, t4713, t4714, t4717, t472, t4721, t4725, t4726, t4729, t473, & - | ^ -note: 't471' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1017:40: + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ +note: 't467' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: - 1017 | t1300 = 0.1e1_dp/t41/t470 - | ^ -Warning: 't470' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:341:45: + 1900 | *t45*t1020*t984*t1027 + | ^ +Warning: 't464' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:78: - 341 | t4627, t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707 - | ^ -note: 't470' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:643:30: + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ +note: 't464' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: - 643 | t399 = t47*t398 - | ^ -Warning: 't47' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:341:39: + 1900 | *t45*t1020*t984*t1027 + | ^ +Warning: 't463' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:72: - 341 | t4627, t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707 - | ^ -note: 't47' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1594:104: + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ +note: 't463' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: - 1594 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 - | ^ -Warning: 't466' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:341:27: + 1900 | *t45*t1020*t984*t1027 + | ^ +Warning: 't459' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:66: - 341 | t4627, t4657, t466, t4696, t47, t470, t4700, t4701, t4704, t4707 - | ^ -note: 't466' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1609:40: + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ +note: 't459' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: - 1609 | *t2763*t446*t2779 - | ^ -Warning: 't462' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:97: + 1900 | *t45*t1020*t984*t1027 + | ^ +Warning: 't458' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:60: - 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & - | ^ -note: 't462' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:713:98: + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ +note: 't458' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: - 713 | t46*t541))*sx - | ^ -Warning: 't46' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:84: + 1900 | *t45*t1020*t984*t1027 + | ^ +Warning: 't457' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:54: - 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & - | ^ -note: 't46' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1523:40: + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ +note: 't457' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: - 1523 | *t1368*t166*t2160 - | ^ + 1900 | *t45*t1020*t984*t1027 + | ^ Warning: 't455' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:58: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:48: - 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & - | ^ + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ note: 't455' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: - 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 - | ^ -Warning: 't451' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:38: + 1900 | *t45*t1020*t984*t1027 + | ^ +Warning: 't454' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:42: - 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & - | ^ -note: 't451' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1594:104: + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ +note: 't454' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1876:39: - 1594 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 - | ^ + 1876 | *t896 - t189*t914 + | ^ Warning: 't450' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:340:25: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:36: - 340 | t4498, t45, t450, t4505, t451, t4512, t4545, t455, t4553, t4575, t4585, t46, t4607, t462, & - | ^ + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ note: 't450' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1417:30: - 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 - | ^ -Warning: 't446' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:84: + 1417 | t195 = t45*t173 + | ^ +Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:30: - 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & - | ^ -note: 't446' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2643:38: + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ +note: 't45' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 2643 | t6144 = t445*t4512*t668 - | ^ -Warning: 't445' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:78: + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ +Warning: 't447' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:25: - 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & - | ^ -note: 't445' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1597:33: + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ +note: 't447' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 1597 | t2763 = t1367*t444 - | ^ + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ Warning: 't444' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:72: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:19: - 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & - | ^ + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ note: 't444' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: - - 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 - | ^ -Warning: 't437' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1868:31: - 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & - | ^ -note: 't437' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1646:57: + 1868 | t945 = t443*t873 + | ^ +Warning: 't443' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1253:13: - 1646 | - 0.5000000001e0_dp*t429*t437*t914 - | ^ -Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:339:20: + 1253 | t443, t444, t447, t45, t450, t454, t455, t457, t458, t459, t463, t464, t467, t472, t473, & + | ^ +note: 't443' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1876:39: - 339 | t4317, t433, t4345, t4352, t437, t4378, t4392, t44, t4428, t444, t445, t446, t4466, & - | ^ -note: 't433' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: + 1876 | *t896 - t189*t914 + | ^ +Warning: 't440' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:96: - 2098 | t3869 + t4657 + t4696) + 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & | ^ -Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:92: +note: 't440' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1876:39: - 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & - | ^ -note: 't43' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2641:38: + 1876 | *t896 - t189*t914 + | ^ +Warning: 't439' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:90: - 2641 | t6138 = t429*t1928*t593 - | ^ -Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:80: + 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & + | ^ +note: 't439' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1885:32: - 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & - | ^ -note: 't429' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1748:30: + 1885 | t1013 = t874*t434 + | ^ +Warning: 't434' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:78: - 1748 | t3305 = t4*t428 - | ^ -Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:74: + 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & + | ^ +note: 't434' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1889:43: - 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & - | ^ -note: 't428' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2637:56: + 1889 | t1027 = t865/t432/t178*t1025 + | ^ +Warning: 't432' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:72: - 2637 | t6126 = 0.1800000000e2_dp*t658*t4764*t425 - | ^ -Warning: 't425' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:40: + 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & + | ^ +note: 't432' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & - | ^ -note: 't425' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1646:57: + 1917 | *bp*t1020*t984*t1027 + | ^ +Warning: 't431' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:66: - 1646 | - 0.5000000001e0_dp*t429*t437*t914 - | ^ -Warning: 't424' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:338:34: + 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & + | ^ +note: 't431' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 338 | t4201, t4214, t4230, t424, t425, t4255, t4256, t4261, t4272, t428, t429, t4292, t43, & - | ^ -note: 't424' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:636:31: + 1917 | *bp*t1020*t984*t1027 + | ^ +Warning: 't430' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:60: - 636 | t383 = t42*omega - | ^ -Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:97: + 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & + | ^ +note: 't430' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1886:30: - 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & - | ^ -note: 't42' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1633:65: + 1886 | t1019 = t427**2 + | ^ +Warning: 't427' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:48: - 1633 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 - | ^ + 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & + | ^ +note: 't427' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + + 1917 | *bp*t1020*t984*t1027 + | ^ +Warning: 't421' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:36: + + 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & + | ^ +note: 't421' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + + 1917 | *bp*t1020*t984*t1027 + | ^ Warning: 't417' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:92: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:19: - 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & - | ^ + 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & + | ^ note: 't417' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 - | ^ -Warning: 't413' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:72: + 1917 | *bp*t1020*t984*t1027 + | ^ +Warning: 't416' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1252:13: - 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & - | ^ -note: 't413' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:790:38: + 1252 | t416, t417, t418, t42, t421, t424, t427, t429, t430, t431, t432, t434, t435, t439, t440, & + | ^ +note: 't416' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 790 | t747 = lambda*t41*omega - | ^ -Warning: 't41' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:52: + 1917 | *bp*t1020*t984*t1027 + | ^ +Warning: 't409' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:87: - 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & - | ^ -note: 't41' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1633:65: + 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & + | ^ +note: 't409' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 1633 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 - | ^ -Warning: 't406' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:33: + 1917 | *bp*t1020*t984*t1027 + | ^ +Warning: 't408' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:81: - 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & - | ^ -note: 't406' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:819:35: + 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & + | ^ +note: 't408' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 819 | *t49*t822*t14 - | ^ -Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:337:27: + 1917 | *bp*t1020*t984*t1027 + | ^ +Warning: 't407' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:75: - 337 | t4025, t4032, t405, t406, t4070, t4079, t41, t4101, t4108, t413, t4140, t4156, t417, t42, & - | ^ -note: 't405' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1621:39: + 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & + | ^ +note: 't407' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: - 1621 | *t400*t401*t2230 - | ^ -Warning: 't401' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:82: + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't406' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:69: - 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & - | ^ -note: 't401' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2449:38: + 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & + | ^ +note: 't406' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 2449 | t5643 = t400*t3975*t561 - | ^ -Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:76: + 1917 | *bp*t1020*t984*t1027 + | ^ +Warning: 't403' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:63: - 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & - | ^ -note: 't400' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1648:41: + 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & + | ^ +note: 't403' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 1648 | t2992 = 0.1e1_dp/t1140/t40 - | ^ + 1917 | *bp*t1020*t984*t1027 + | ^ +Warning: 't402' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:57: + + 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & + | ^ +note: 't402' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1413:30: + + 1413 | t189 = t40*t155 + | ^ Warning: 't40' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:70: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:51: - 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & - | ^ + 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & + | ^ note: 't40' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1069:30: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1525:35: - 1069 | t1409 = t4*t164 - | ^ + 1525 | t355 = t4**0.20e1_dp + | ^ Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:65: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:46: - 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & - | ^ + 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & + | ^ note: 't4' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1327:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 1327 | t1912 = t399*t245 - | ^ + 1917 | *bp*t1020*t984*t1027 + | ^ Warning: 't399' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:61: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:42: - 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & - | ^ + 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & + | ^ note: 't399' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1726:34: - - 1726 | t3278 = my_rho*t398 - | ^ -Warning: 't398' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:336:48: - - 336 | t3940, t3965, t3969, t3975, t3979, t398, t3985, t399, t4, t40, t400, t401, t4010, t4018, & - | ^ -note: 't398' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1594:104: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1865:62: - 1594 | *t394) + 0.5000000001e0_dp*t165*t2720*t237 - | ^ + 1865 | *t394*t874 - 0.9531842928e0_dp*t161*t887 + | ^ Warning: 't394' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:335:94: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:36: - 335 | REAL(KIND=dp) :: t387, t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, & - | ^ + 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & + | ^ note: 't394' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2051:58: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2031:47: - 2051 | + 0.3333333334e0_dp*t165*t437*t1688 - | ^ + 2031 | *t560*t1394 - t239*t1404 + | ^ Warning: 't393' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:335:74: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:30: - 335 | REAL(KIND=dp) :: t387, t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, & - | ^ + 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & + | ^ note: 't393' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1646:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1877:39: - 1646 | - 0.5000000001e0_dp*t429*t437*t914 - | ^ -Warning: 't392' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:335:61: + 1877 | t972 = t39**(-0.40e1_dp) + | ^ +Warning: 't39' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1251:12: - 335 | REAL(KIND=dp) :: t387, t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, & - | ^ -note: 't392' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1062:29: + 1251 | t39, t390, t392, t393, t394, t399, t4, t40, t402, t403, t406, t407, t408, t409, t415, & + | ^ +note: 't39' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 1062 | *t1397 - | ^ -Warning: 't387' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:335:27: + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ +Warning: 't389' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:95: - 335 | REAL(KIND=dp) :: t387, t3871, t3875, t3892, t3918, t392, t3925, t393, t3933, t3939, t394, & - | ^ -note: 't387' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1736:66: + 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & + | ^ +note: 't389' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1861:49: - 1736 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 - | ^ + 1861 | t903 = 0.1211413728e1_dp*t388*t873 + | ^ +Warning: 't388' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:89: + + 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & + | ^ +note: 't388' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1858:31: + + 1858 | t893 = t385*t164 + | ^ +Warning: 't385' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:83: + + 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & + | ^ +note: 't385' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: + + 1917 | *bp*t1020*t984*t1027 + | ^ Warning: 't384' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:334:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:77: - 334 | t3826, t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869 - | ^ + 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & + | ^ note: 't384' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2327:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 2327 | t5335 = 0.2222222224e0_dp*t383*t5281 - | ^ + 1917 | *bp*t1020*t984*t1027 + | ^ Warning: 't383' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:334:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:71: - 334 | t3826, t3827, t383, t384, t3842, t3849, t3853, t3861, t3865, t3869 - | ^ + 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & + | ^ note: 't383' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1062:29: - - 1062 | *t1397 - | ^ -Warning: 't380' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:97: - - 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & - | ^ -note: 't380' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1736:66: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2017:32: - 1736 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 - | ^ + 2017 | t1380 = t379*t217 + | ^ Warning: 't379' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:77: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:60: - 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & - | ^ + 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & + | ^ note: 't379' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2433:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 2433 | t5602 = 0.40e1_dp*t624*t376 - | ^ + 1917 | *bp*t1020*t984*t1027 + | ^ Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:64: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:54: - 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & - | ^ + 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & + | ^ note: 't376' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1568:55: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 1568 | 0.5866666667e2_dp*t962*t949*t375 - | ^ + 1917 | *bp*t1020*t984*t1027 + | ^ Warning: 't375' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:48: - 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & - | ^ + 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & + | ^ note: 't375' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1200:48: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2013:32: - 1200 | t1662 = 0.3200000000e2_dp*t7*t372 - | ^ + 2013 | t1371 = t372*t217 + | ^ Warning: 't372' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:36: - 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & - | ^ + 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & + | ^ note: 't372' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2212:29: - 1550 | *t2565*t796 - | ^ + 2212 | *t1776 + | ^ Warning: 't371' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:25: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:30: - 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & - | ^ + 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & + | ^ note: 't371' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:718:61: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1844:40: - 718 | t561 = 0.40e1_dp*t24*t37 - 0.20e1_dp*t102*t558 - | ^ -Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:333:19: + 1844 | t864 = 0.1e1_dp/t370/t130 + | ^ +Warning: 't370' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:24: - 333 | t3682, t37, t371, t3711, t372, t3726, t375, t3750, t376, t3763, t379, t3794, t3796, t380, & - | ^ -note: 't37' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: + 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & + | ^ +note: 't370' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1601:54: - 1550 | *t2565*t796 - | ^ -Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:92: + 1601 | t473*t435)*t51 + | ^ +Warning: 't37' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1250:18: - 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & - | ^ -note: 't368' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:862:31: + 1250 | t369, t37, t370, t371, t372, t373, t375, t376, t379, t38, t383, t384, t385, t388, t389, & + | ^ +note: 't37' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1851:31: - 862 | t942 = t367*t306 + 1851 | t875 = t367*t874 | ^ Warning: 't367' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:58: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:87: - 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & - | ^ + 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & + | ^ note: 't367' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2392:38: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2014:38: - 2392 | t5496 = t366*t368*t1681 + 2014 | t1372 = t366*t212*t1371 | ^ Warning: 't366' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:45: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:81: - 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & - | ^ + 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & + | ^ note: 't366' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2165:60: - 1550 | *t2565*t796 - | ^ + 2165 | *t743 - 0.160e2_dp*t764 - t492 + t365 + | ^ Warning: 't365' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:75: - 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & - | ^ + 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & + | ^ note: 't365' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1201:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: - 1201 | t1664 = 0.60e1_dp*t550*t362 - | ^ -Warning: 't362' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:33: + 2099 | + t842 - t1609 + | ^ +Warning: 't364' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:69: - 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & - | ^ -note: 't362' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: + 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & + | ^ +note: 't364' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2099:37: - 1550 | *t2565*t796 - | ^ -Warning: 't360' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:332:13: + 2099 | + t842 - t1609 + | ^ +Warning: 't363' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:63: - 332 | t360, t3608, t3618, t362, t365, t366, t3668, t367, t3673, t3674, t3677, t3679, t368, & - | ^ -note: 't360' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:559:30: + 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & + | ^ +note: 't363' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2009:32: - 559 | t221 = t220*t36 - | ^ -Warning: 't36' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:331:94: + 2009 | t1361 = t362*t202 + | ^ +Warning: 't362' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:57: - 331 | t3546, t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, & - | ^ -note: 't36' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: + 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & + | ^ +note: 't362' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2075:32: - 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 - | ^ + 2075 | t1582 = t359*t254 + | ^ +Warning: 't359' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:51: + + 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & + | ^ +note: 't359' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2073:32: + + 2073 | t1578 = t357*t254 + | ^ Warning: 't357' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:331:61: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:45: - 331 | t3546, t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, & - | ^ + 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & + | ^ note: 't357' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:905:35: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2142:75: - 905 | t1002*my_rho - | ^ + 2142 | t1626 - 0.1200e2_dp*t356*t340*t309 - 0.40e1_dp*t1668 + | ^ Warning: 't356' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:331:41: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:39: - 331 | t3546, t3547, t3552, t3553, t356, t3561, t3569, t357, t3575, t3576, t3580, t3581, t36, & - | ^ + 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & + | ^ note: 't356' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1197:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2130:32: - 1197 | t1656 = 0.8000000000e1_dp*t1429*t352 - | ^ + 2130 | t1697 = t315*t355 + | ^ +Warning: 't355' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:33: + + 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & + | ^ +note: 't355' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2010:32: + + 2010 | t1363 = t353*t254 + | ^ +Warning: 't353' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1249:27: + + 1249 | REAL(KIND=dp) :: t353, t355, t356, t357, t359, t362, t363, t364, t365, t366, t367, t368, & + | ^ +note: 't353' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2202:58: + + 2202 | *t1897*t92 - 0.1200e2_dp*t750*t1901 + | ^ Warning: 't352' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:330:73: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:72: - 330 | t3497, t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, & - | ^ + 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 + | ^ note: 't352' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1939:32: - 1850 | *t786*t1034*t1681 - | ^ -Warning: 't350' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:330:25: + 1939 | t1137 = t351*t305 + | ^ +Warning: 't351' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:66: - 330 | t3497, t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, & - | ^ -note: 't350' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1559:40: + 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 + | ^ +note: 't351' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1930:32: - 1559 | t2585 = 0.1e1_dp/t972/t35 - | ^ -Warning: 't35' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:330:19: + 1930 | t1110 = t350*t142 + | ^ +Warning: 't350' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:60: - 330 | t3497, t35, t350, t3501, t3505, t3507, t3512, t3513, t3514, t352, t3525, t3533, t3543, & - | ^ -note: 't35' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2387:51: + 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 + | ^ +note: 't350' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2111:34: - 2387 | t5484 = 0.1760000000e3_dp*t5460*t347 - | ^ + 2111 | *t136*t1639 + | ^ Warning: 't347' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:72: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:54: - 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & - | ^ + 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 + | ^ note: 't347' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1193:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1928:28: - 1193 | t1647 = 0.5600000000e2_dp*t1645*t343 - | ^ + 1928 | t1096 + | ^ +Warning: 't344' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:48: + + 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 + | ^ +note: 't344' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2225:34: + + 2225 | *t136*t1986 + | ^ Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:52: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:42: - 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & - | ^ + 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 + | ^ note: 't343' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2152:64: - 1841 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:46: + 2152 | *t125*t340*t309 + t1775 - 0.40e1_dp*t1776 + | ^ +Warning: 't340' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:36: - 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & - | ^ -note: 't342' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: + 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 + | ^ +note: 't340' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2207:29: - 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 - | ^ -Warning: 't341' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:40: + 2207 | *t1094 + | ^ +Warning: 't338' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:25: - 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & - | ^ -note: 't341' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 + | ^ +note: 't338' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2188:64: - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:329:34: + 2188 | *t133*t90*t91*t789 + 0.80e1_dp*t1671*t327 + | ^ +Warning: 't337' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:19: - 329 | t3378, t3379, t3382, t339, t341, t342, t343, t3449, t3453, t347, t3472, t3491, t3494, & - | ^ -note: 't339' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1188:49: + 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 + | ^ +note: 't337' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2142:75: - 1188 | t1638 = 0.1200000000e3_dp*t24*t336 - | ^ -Warning: 't336' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:328:76: + 2142 | t1626 - 0.1200e2_dp*t356*t340*t309 - 0.40e1_dp*t1668 + | ^ +Warning: 't333' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1248:13: - 328 | REAL(KIND=dp) :: t3339, t3344, t3347, t3352, t3353, t3356, t3357, t336, t3362, t3363, t3366, & - | ^ -note: 't336' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1202:79: + 1248 | t333, t337, t338, t34, t340, t343, t344, t347, t350, t351, t352 + | ^ +note: 't333' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2225:34: - 1202 | t1667 = 0.28e2_dp/0.3e1_dp*t332 - 0.28e2_dp/0.3e1_dp*t987*my_rho - | ^ + 2225 | *t136*t1986 + | ^ Warning: 't332' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:80: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:96: - 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 - | ^ + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ note: 't332' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1747:63: - - 1747 | e_rho_rho_rho(ii) = e_rho_rho_rho(ii) + t3291*sx - | ^ -Warning: 't3291' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:53: - - 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 - | ^ -note: 't3291' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1172:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: - 1172 | t1615 = 0.80e1_dp*t112*t329 - | ^ + 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc + | ^ Warning: 't329' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:46: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:90: - 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 - | ^ + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ note: 't329' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1568:55: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1835:88: - 1568 | 0.5866666667e2_dp*t962*t949*t375 - | ^ + 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc + | ^ Warning: 't328' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:84: - 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 - | ^ + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ note: 't328' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1881:32: - - 1881 | t3842 = t3278*t46 - | ^ -Warning: 't3278' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:27: - - 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 - | ^ -note: 't3278' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1558:85: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1821:31: - 1558 | - 0.20e1_dp*t102*t105*t2569 - 0.6400000001e2_dp*t321*t953*t979 - | ^ + 1821 | t825 = t732*t327 + | ^ Warning: 't327' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:327:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:78: - 327 | t3268, t327, t3278, t328, t3288, t329, t3291, t3305, t3306, t3314, t332, t3329 - | ^ + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ note: 't327' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1932:32: - - 1932 | t4025 = t3262*t57 - | ^ -Warning: 't3262' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:85: - - 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & - | ^ -note: 't3262' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1161:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1835:88: - 1161 | t1598 = t326*my_rho - | ^ + 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc + | ^ Warning: 't326' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:78: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:72: - 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & - | ^ + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ note: 't326' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2061:71: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: - 2061 | *t3507 - t3512)*t149*t160 - | ^ -Warning: 't3248' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:72: + 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc + | ^ +Warning: 't325' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:66: - 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & - | ^ -note: 't3248' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ +note: 't325' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1835:88: - 2034 | *t1246*t3244*t1483 - | ^ -Warning: 't3244' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:65: + 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc + | ^ +Warning: 't324' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:60: - 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & - | ^ -note: 't3244' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2420:51: + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ +note: 't324' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1835:88: - 2420 | t5568 = 0.1066666667e2_dp*t1645*t322 - | ^ + 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc + | ^ +Warning: 't323' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:54: + + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ +note: 't323' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2101:32: + + 2101 | t1613 = t322*t591 + | ^ Warning: 't322' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:51: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:48: - 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & - | ^ + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ note: 't322' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2382:57: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1835:88: - 2382 | t5472 = 0.3200000001e2_dp*t321*t2455*t5079 - | ^ + 1835 | + t712 + 0.2e1_dp*t326 + 0.80e1_dp*t328 + t715)*sc + | ^ Warning: 't321' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:45: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:42: - 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & - | ^ + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ note: 't321' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1159:43: - - 1159 | t1596 = 0.320e2_dp*t605*t318 - | ^ -Warning: 't318' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:32: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2145:32: - 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & + 2145 | t1765 = t320*t479 | ^ -note: 't318' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1568:55: +Warning: 't320' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:36: - 1568 | 0.5866666667e2_dp*t962*t949*t375 - | ^ + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ +note: 't320' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2148:32: + + 2148 | t1776 = t317*t591 + | ^ Warning: 't317' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:26: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:25: - 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & - | ^ + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ note: 't317' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1568:55: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2129:32: - 1568 | 0.5866666667e2_dp*t962*t949*t375 - | ^ + 2129 | t1696 = t316*t704 + | ^ Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:326:20: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:19: - 326 | t3141, t316, t317, t318, t3181, t321, t322, t3232, t3244, t3248, t326, t3262, t3264, & - | ^ + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ note: 't316' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2377:51: - - 2377 | t5462 = 0.1173333333e3_dp*t5460*t313 - | ^ -Warning: 't313' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:91: - - 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & - | ^ -note: 't313' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: - - 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 - | ^ -Warning: 't311' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:78: - - 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & - | ^ -note: 't311' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:715:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2130:32: - 715 | t551 = t27*t31 - | ^ -Warning: 't31' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:72: + 2130 | t1697 = t315*t355 + | ^ +Warning: 't315' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1247:13: - 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & - | ^ -note: 't31' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: + 1247 | t315, t316, t317, t32, t320, t321, t322, t323, t324, t325, t326, t327, t328, t329, t332, & + | ^ +note: 't315' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2225:34: - 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 - | ^ -Warning: 't3097' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:60: + 2225 | *t136*t1986 + | ^ +Warning: 't312' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:94: - 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & - | ^ -note: 't3097' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:890:40: + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ +note: 't312' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1751:31: - 890 | t1002 = 0.1e1_dp/t19/t309 - | ^ + 1751 | t730 = t352*t309 + | ^ Warning: 't309' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:46: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:88: - 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & - | ^ + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ note: 't309' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:900:31: - - 900 | t1033 = t308*t12 - | ^ -Warning: 't308' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:33: - - 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & - | ^ -note: 't308' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2435:56: - - 2435 | t5607 = 0.5866666667e2_dp*t307*t949*t5069 - | ^ -Warning: 't307' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:325:20: - - 325 | t3069, t307, t3070, t308, t3085, t309, t3093, t3097, t3098, t31, t311, t3129, t313, & - | ^ -note: 't307' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:858:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1739:35: - 858 | t929 = t306*t311 - | ^ + 1739 | t715 = 0.2e1_dp*t306 + | ^ Warning: 't306' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:92: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:82: - 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & - | ^ + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ note: 't306' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: - - 1965 | *t478*t183*t3918 - | ^ -Warning: 't3030' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:86: - - 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & - | ^ -note: 't3030' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: - - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't302' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:72: - - 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & - | ^ -note: 't302' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: - - 1965 | *t478*t183*t3918 - | ^ -Warning: 't2998' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:66: - - 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & - | ^ -note: 't2998' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2147:41: - 1965 | *t478*t183*t3918 - | ^ -Warning: 't2994' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:59: + 2147 | t1775 = 0.2e1_dp*t729*t305 + | ^ +Warning: 't305' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:76: - 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & - | ^ -note: 't2994' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2778:29: + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ +note: 't305' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2123:54: - 2778 | *t6271 - | ^ -Warning: 't2992' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:52: + 2123 | t1690 = 0.2400e2_dp*t771*t304*t133*t309 + | ^ +Warning: 't304' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:70: - 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & - | ^ -note: 't2992' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1149:49: + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ +note: 't304' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1491:32: - 1149 | t1579 = 0.1173333333e3_dp*t24*t299 - | ^ -Warning: 't299' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:45: + 1491 | t309 = -t3 - t132 + | ^ +Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:64: - 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & - | ^ -note: 't299' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1160:30: + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ +note: 't3' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: - 1160 | t1597 = t7*t298 - | ^ + 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + | ^ Warning: 't298' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:39: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:60: - 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & - | ^ + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ note: 't298' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1062:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1724:31: - 1062 | *t1397 - | ^ + 1724 | t691 = t297*t393 + | ^ +Warning: 't297' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:54: + + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ +note: 't297' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1983:71: + + 1983 | *t1221 + 0.2566001193e0_dp*t116*t1245*t984*t1252 + | ^ Warning: 't295' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:48: - 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & - | ^ + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ note: 't295' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1718:31: - 1744 | + t3288) - | ^ + 1718 | t679 = t678*t294 + | ^ Warning: 't294' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:27: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:42: - 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & - | ^ + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ note: 't294' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2051:58: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1720:31: - 2051 | + 0.3333333334e0_dp*t165*t437*t1688 - | ^ -Warning: 't2937' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:324:21: + 1720 | t682 = t293*t681 + | ^ +Warning: 't293' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:36: - 324 | t2935, t2937, t294, t295, t298, t299, t2992, t2994, t2998, t302, t3026, t3030, t306, & - | ^ -note: 't2937' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1736:66: + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ +note: 't293' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1717:43: - 1736 | *t1068 + 0.8333333340e-1_dp*t906*t384*t2160 - | ^ -Warning: 't290' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:94: + 1717 | t674*t619 - t291*t627 + | ^ +Warning: 't291' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:30: - 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & - | ^ -note: 't290' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2656:38: + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ +note: 't291' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1571:39: - 2656 | t6181 = t289*t1564*t593 - | ^ -Warning: 't289' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:88: + 1571 | t429 = 0.1e1_dp/t427/t29 + | ^ +Warning: 't29' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:24: - 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & - | ^ -note: 't289' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2343:39: + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ +note: 't29' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1971:47: - 2343 | t5373 = t2885*t446*t5371 - | ^ -Warning: 't2885' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:82: + 1971 | *t674*t1171 - t291*t1181 + | ^ +Warning: 't288' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:19: - 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & - | ^ -note: 't2885' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ +note: 't288' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1971:47: - 1923 | t1320*t1483 - | ^ -Warning: 't2873' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:68: + 1971 | *t674*t1171 - t291*t1181 + | ^ +Warning: 't287' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1246:13: - 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & - | ^ -note: 't2873' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1066:96: + 1246 | t287, t288, t29, t291, t293, t294, t295, t297, t298, t3, t304, t305, t306, t309, t312, & + | ^ +note: 't287' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1704:31: - 1066 | t804 - 0.4444444448e0_dp*t43*t894 + t8*t1401)*sx - | ^ + 1704 | t651 = t379*t283 + | ^ Warning: 't283' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:33: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:89: - 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & - | ^ + 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & + | ^ note: 't283' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1910:40: - - 1910 | *t400*t1333*t1410 - | ^ -Warning: 't2823' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:27: - - 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & - | ^ -note: 't2823' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2709:36: - - 2709 | t5011 + t5001 - | ^ -Warning: 't2821' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:20: - - 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & - | ^ -note: 't2821' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1964:43: - 1744 | + t3288) - | ^ + 1964 | t1252 = t865/t659/t282*t1250 + | ^ Warning: 't282' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:323:13: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:83: - 323 | t282, t2821, t2823, t283, t2833, t2843, t2853, t2869, t2873, t2877, t2885, t289, t290, & - | ^ + 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & + | ^ note: 't282' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1910:40: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1963:30: - 1910 | *t400*t1333*t1410 - | ^ -Warning: 't2808' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:87: + 1963 | t1250 = t280**2 + | ^ +Warning: 't280' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:77: - 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & - | ^ -note: 't2808' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: + 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & + | ^ +note: 't280' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 - | ^ -Warning: 't278' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:73: + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't279' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:66: - 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & - | ^ -note: 't278' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2346:59: + 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & + | ^ +note: 't279' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1703:31: - 2346 | t5383 = 0.4166666667e-1_dp*t2763*t1247*t5002 - | ^ -Warning: 't2763' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:60: + 1703 | t648 = t278*t393 + | ^ +Warning: 't278' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:60: - 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & + 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & | ^ -note: 't2763' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1691:34: - - 1691 | *t503*t2312 - | ^ -Warning: 't275' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:46: - - 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & - | ^ -note: 't275' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1808:33: - - 1808 | t3569 = t274*t1505 - | ^ -Warning: 't274' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:40: - - 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & - | ^ -note: 't274' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: +note: 't278' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1957:41: - 2034 | *t1246*t3244*t1483 + 1957 | t1218 = 0.1e1_dp/t654/t276 | ^ -Warning: 't2720' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:20: - - 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & - | ^ -note: 't2720' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1678:69: - - 1678 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 - | ^ -Warning: 't271' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:322:13: - - 322 | t271, t2720, t2724, t2732, t274, t275, t2759, t2763, t2779, t278, t2783, t2808, t2816, & - | ^ -note: 't271' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: - - 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 - | ^ -Warning: 't2707' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:92: +Warning: 't276' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:48: - 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & - | ^ -note: 't2707' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:715:29: + 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & + | ^ +note: 't276' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 715 | t551 = t27*t31 - | ^ -Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:85: + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't273' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:42: - 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & - | ^ -note: 't27' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: + 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & + | ^ +note: 't273' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1696:31: - 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 - | ^ -Warning: 't268' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:80: + 1696 | t634 = t272*t406 + | ^ +Warning: 't272' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:36: - 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & - | ^ -note: 't268' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1710:83: + 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & + | ^ +note: 't272' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1733:62: - 1710 | 0.1666666668e0_dp*t508*t1207 - 0.3333333336e0_dp*t1137*t1134 - | ^ -Warning: 't267' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:74: + 1733 | *t697*t662)*t122) + | ^ +Warning: 't269' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:25: - 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & - | ^ -note: 't267' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1678:69: + 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & + | ^ +note: 't269' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1953:63: - 1678 | *(t199)*(t2281) - 0.1851851853e0_dp*t508*t1201 - | ^ + 1953 | *t622*t874 - 0.9531842928e0_dp*t266*t887 + | ^ Warning: 't266' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:68: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:19: - 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & - | ^ + 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & + | ^ note: 't266' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: - - 2079 | *t289*t294*t1553 - | ^ -Warning: 't2636' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:42: - - 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & - | ^ -note: 't2636' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 2087 | *t83*t45*t3581*t140 - | ^ -Warning: 't2631' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:321:28: + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't265' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1245:13: - 321 | REAL(KIND=dp) :: t2631, t2635, t2636, t264, t2645, t2655, t266, t267, t268, t27, t2707, & - | ^ -note: 't2631' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1286:32: + 1245 | t265, t266, t269, t27, t272, t273, t276, t277, t278, t279, t28, t280, t282, t283, t284, & + | ^ +note: 't265' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1943:38: - 1286 | t1821 = t472*t262 - | ^ -Warning: 't262' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:66: + 1943 | t1149 = t366*t264*t1148 + | ^ +Warning: 't264' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:97: - 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 - | ^ -note: 't262' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2371:57: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't264' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1948:30: - 2371 | t5449 = 0.1173333333e3_dp*t307*t2611*t5065 - | ^ -Warning: 't2611' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:60: + 1948 | t1165 = t263**2 + | ^ +Warning: 't263' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:91: - 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 - | ^ -note: 't2611' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2476:73: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't263' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1999:61: - 2476 | t5716 = 0.1620000000e3_dp*t4994*t392*t4769*t1141*t26*t5713 - | ^ -Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:47: + 1999 | *bf*t1245*t984*t1252 - t109*t1341*t122 + | ^ +Warning: 't260' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:85: - 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 - | ^ -note: 't26' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1858:33: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't260' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: - 1858 | t3750 = t2585*t136 - | ^ -Warning: 't2585' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:42: + 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc + | ^ +Warning: 't259' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:79: - 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 - | ^ -note: 't2585' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2400:67: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't259' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1742:88: - 2400 | *t5511 + 0.1200000000e3_dp*t1055*t2565*t4721 - | ^ -Warning: 't2565' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:21: + 1742 | + t712 + 0.2e1_dp*t256 + 0.80e1_dp*t258 + t715)*sc + | ^ +Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:73: - 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 - | ^ -note: 't2565' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1832:32: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't258' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1669:31: - 1832 | t3668 = t2552*t23 - | ^ -Warning: 't2552' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:320:14: + 1669 | t594 = t352*t257 + | ^ +Warning: 't257' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:67: - 320 | t2552, t2565, t2569, t2576, t2585, t26, t260, t2611, t262, t2621, t2622 - | ^ -note: 't2552' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't257' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: - 1841 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't2537' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:93: + 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc + | ^ +Warning: 't256' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:61: - 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & - | ^ -note: 't2537' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't256' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1738:35: - 2233 | + t5032 + t5035 - | ^ -Warning: 't250' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:86: + 1738 | t712 = 0.2e1_dp*t255 + | ^ +Warning: 't255' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:55: - 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & - | ^ -note: 't250' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:707:26: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't255' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1613:31: - 707 | t537 - | ^ -Warning: 't25' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:80: + 1613 | t491 = t144*t254 + | ^ +Warning: 't254' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:49: - 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & - | ^ -note: 't25' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2155:59: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't254' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2146:49: - 2155 | - 0.2400000000e2_dp*t786/t2492*t1058 - | ^ -Warning: 't2492' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:75: + 2146 | t1768 = 0.2400e2_dp*t750*t253*t751 + | ^ +Warning: 't253' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:43: - 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & - | ^ -note: 't2492' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1523:40: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't253' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2138:52: - 1523 | *t1368*t166*t2160 - | ^ -Warning: 't249' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:68: + 2138 | t1730 = 0.160e2_dp*t755*t756*t252*t91 + | ^ +Warning: 't252' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:37: - 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & - | ^ -note: 't249' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't252' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 - | ^ -Warning: 't2480' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:62: + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ +Warning: 't246' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:31: - 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & - | ^ -note: 't2480' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't246' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1657:31: - 1857 | *t321*t953*t1625 - | ^ -Warning: 't2468' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:55: + 1657 | t577 = t245*t393 + | ^ +Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:25: - 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & - | ^ -note: 't2468' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2382:57: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't245' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2054:69: - 2382 | t5472 = 0.3200000001e2_dp*t321*t2455*t5079 - | ^ -Warning: 't2455' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:48: + 2054 | t1493 + 0.2566001193e0_dp*t80*t1517*t984*t1524 + | ^ +Warning: 't243' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:19: - 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & - | ^ -note: 't2455' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1327:32: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't243' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1651:31: - 1327 | t1912 = t399*t245 - | ^ -Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:319:34: + 1651 | t565 = t564*t242 + | ^ +Warning: 't242' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1244:13: - 319 | t2424, t2437, t2439, t245, t2451, t2455, t2468, t2480, t249, t2492, t25, t250, t2537, & - | ^ -note: 't245' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: + 1244 | t242, t243, t245, t246, t252, t253, t254, t255, t256, t257, t258, t259, t260, t263, t264, & + | ^ +note: 't242' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1653:31: - 2079 | *t289*t294*t1553 - | ^ -Warning: 't2404' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:86: + 1653 | t568 = t241*t567 + | ^ +Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:95: - 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & - | ^ -note: 't2404' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:615:30: + 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & + | ^ +note: 't241' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1388:30: - 615 | t350 = t24*t225 + 1388 | t150 = t149*t24 | ^ Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:79: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:89: - 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & - | ^ + 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & + | ^ note: 't24' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1650:43: - 1744 | + t3288) - | ^ -Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:53: + 1650 | t560*t505 - t239*t513 + | ^ +Warning: 't239' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:84: - 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & - | ^ -note: 't237' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1152:44: + 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & + | ^ +note: 't239' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2031:47: - 1152 | t1584 = 0.320e2_dp*t1582*t234 - | ^ -Warning: 't234' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:33: + 2031 | *t560*t1394 - t239*t1404 + | ^ +Warning: 't236' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:78: - 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & - | ^ -note: 't234' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1558:85: + 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & + | ^ +note: 't236' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1637:31: - 1558 | - 0.20e1_dp*t102*t105*t2569 - 0.6400000001e2_dp*t321*t953*t979 - | ^ -Warning: 't233' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:318:27: + 1637 | t537 = t379*t231 + | ^ +Warning: 't231' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:60: - 318 | t2319, t2326, t233, t234, t2351, t2368, t237, t2378, t2382, t2392, t24, t2404, t2418, & - | ^ -note: 't233' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1083:53: + 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & + | ^ +note: 't231' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2043:43: - 1083 | + 0.8000000000e1_dp*t366*t1440 - | ^ + 2043 | t1524 = t865/t545/t230*t1522 + | ^ Warning: 't230' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:317:53: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:54: - 317 | t2287, t2292, t2295, t2296, t2299, t23, t230, t2300, t2304, t2307, t2308, t2311, t2312, & - | ^ + 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & + | ^ note: 't230' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1173:29: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1420:70: - 1173 | t1616 = t7*t23 - | ^ + 1420 | t37*(t193*t23 + 0.3177280975e0_dp*t196*t180)*t51 + | ^ Warning: 't23' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:317:47: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:48: - 317 | t2287, t2292, t2295, t2296, t2299, t23, t230, t2300, t2304, t2307, t2308, t2311, t2312, & - | ^ + 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & + | ^ note: 't23' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1650:31: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2042:30: - 1650 | t2998 = t27*t225 + 2042 | t1522 = t228**2 + | ^ +Warning: 't228' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:43: + + 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & + | ^ +note: 't228' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: + + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't227' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:37: + + 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & + | ^ +note: 't227' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1636:31: + + 1636 | t534 = t226*t393 | ^ -Warning: 't225' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:92: +Warning: 't226' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:31: - 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & - | ^ -note: 't225' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:887:40: + 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & + | ^ +note: 't226' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2036:41: - 887 | t995 = 0.1e1_dp/t787/t224 - | ^ + 2036 | t1490 = 0.1e1_dp/t540/t224 + | ^ Warning: 't224' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:86: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:19: - 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & - | ^ + 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & + | ^ note: 't224' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: - - 1850 | *t786*t1034*t1681 - | ^ -Warning: 't2220' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:59: - - 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & - | ^ -note: 't2220' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1087:28: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: - 1087 | t1444 - | ^ + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:52: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1243:13: - 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & - | ^ + 1243 | t221, t224, t225, t226, t227, t228, t23, t230, t231, t232, t235, t236, t239, t24, t241, & + | ^ note: 't221' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1629:31: - 1550 | *t2565*t796 - | ^ + 1629 | t520 = t220*t406 + | ^ Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:18: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:94: - 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & - | ^ + 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & + | ^ note: 't220' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:605:30: - - 605 | t327 = t22*t326 - | ^ -Warning: 't22' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:315:12: - - 315 | t22, t220, t2200, t2201, t2204, t2205, t221, t2220, t2226, t2227, t2230, t224, t225, & - | ^ -note: 't22' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:885:31: - - 885 | t987 = t219*t341 - | ^ -Warning: 't219' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:314:67: - - 314 | REAL(KIND=dp) :: t2169, t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, & - | ^ -note: 't219' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: - - 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 - | ^ -Warning: 't2182' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:314:47: - - 314 | REAL(KIND=dp) :: t2169, t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, & - | ^ -note: 't2182' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1550:34: - - 1550 | *t2565*t796 - | ^ -Warning: 't218' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:314:40: - - 314 | REAL(KIND=dp) :: t2169, t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, & - | ^ -note: 't218' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2164:42: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1666:64: - 2164 | t4864 = t217*t46*t1535*t561 - | ^ + 1666 | *t583*t548)*t86)*t91 + | ^ Warning: 't217' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:314:34: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:88: - 314 | REAL(KIND=dp) :: t2169, t217, t218, t2182, t2183, t2187, t219, t2190, t2193, t2196, t2197, & - | ^ + 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & + | ^ note: 't217' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2101:56: - - 2101 | t4704 = 0.3333333336e0_dp*t2147*t84*t4701 - | ^ -Warning: 't2147' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:62: - - 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 - | ^ -note: 't2147' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2136:55: - - 2136 | t4789 = 0.4444444448e0_dp*t214*t46*t4786 - | ^ -Warning: 't214' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:48: - - 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 - | ^ -note: 't214' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2738:79: - - 2738 | *t6181 - t6185 + t6189 - t6192 - 0.3333333336e0_dp*t6194 - | ^ -Warning: 't2139' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:42: - - 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 - | ^ -note: 't2139' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2753:90: - - 2753 | t5418 + 0.1800000000e2_dp*t658*t575*t2074 + 0.1800000000e2_dp*t5421 - | ^ -Warning: 't2131' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:28: - - 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 - | ^ -note: 't2131' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2790:82: - - 2790 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 - | ^ -Warning: 't2126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:313:14: - - 313 | t2126, t2130, t2131, t2138, t2139, t214, t2143, t2147, t2160 - | ^ -note: 't2126' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2810:46: - - 2810 | *t60*t2124*t709 - t6044 - | ^ -Warning: 't2124' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:91: - - 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & - | ^ -note: 't2124' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2790:82: - - 2790 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 - | ^ -Warning: 't2118' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:84: - - 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & - | ^ -note: 't2118' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2794:41: - - 2794 | *t5228*t2117*t2028 - | ^ -Warning: 't2117' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:77: - - 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & - | ^ -note: 't2117' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2790:82: - - 2790 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 - | ^ -Warning: 't2114' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:70: - - 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & - | ^ -note: 't2114' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2810:46: - - 2810 | *t60*t2124*t709 - t6044 - | ^ -Warning: 't2113' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:63: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2024:63: - 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & + 2024 | *t508*t874 - 0.9531842928e0_dp*t214*t887 | ^ -note: 't2113' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2800:60: - - 2800 | t6260 + 0.8999999998e1_dp*t5229*t2104 - | ^ -Warning: 't2104' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:49: - - 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & - | ^ -note: 't2104' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2778:29: - - 2778 | *t6271 - | ^ -Warning: 't2099' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:42: - - 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & - | ^ -note: 't2099' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2794:41: - - 2794 | *t5228*t2117*t2028 - | ^ -Warning: 't2098' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:35: - - 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & - | ^ -note: 't2098' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2790:82: +Warning: 't214' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:82: - 2790 | *t719*t2126 - t5973 + t5975 + 0.5999999999e1_dp*t2114*t6257 + 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ -Warning: 't2095' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:28: - - 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & - | ^ -note: 't2095' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: - - 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) - | ^ -Warning: 't2088' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:312:21: +note: 't214' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: - 312 | t2086, t2088, t2095, t2098, t2099, t2104, t2107, t2113, t2114, t2117, t2118, t2124, & - | ^ -note: 't2088' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:76: - 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) + 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ -Warning: 't2082' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:97: - - 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & - | ^ -note: 't2082' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2768:38: +note: 't213' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2014:38: - 2768 | - t6090 + t6094 + 2014 | t1372 = t366*t212*t1371 | ^ -Warning: 't2081' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:90: +Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:70: - 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & - | ^ -note: 't2081' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: + 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & + | ^ +note: 't212' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2019:30: - 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) - | ^ -Warning: 't2077' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:83: + 2019 | t1388 = t211**2 + | ^ +Warning: 't211' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:64: - 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & - | ^ -note: 't2077' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2753:90: + 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & + | ^ +note: 't211' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2070:73: - 2753 | t5418 + 0.1800000000e2_dp*t658*t575*t2074 + 0.1800000000e2_dp*t5421 - | ^ -Warning: 't2074' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:76: + 2070 | t859*t1493 + 0.5132002385e0_dp*ba*t1517*t984*t1524 + | ^ +Warning: 't208' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:58: - 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & - | ^ -note: 't2074' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: + 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & + | ^ +note: 't208' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: - 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 - | ^ + 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc + | ^ Warning: 't207' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:62: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:52: - 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & - | ^ + 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & + | ^ note: 't207' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2739:33: - - 2739 | t6400 = t2061*t561 - | ^ -Warning: 't2061' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:56: - - 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & - | ^ -note: 't2061' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2731:78: - - 2731 | - t5595 + t5597 - t5600 - t5602 + t5604 + t5607 + t5610 - | ^ -Warning: 't2058' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:49: - - 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & - | ^ -note: 't2058' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2721:79: - - 2721 | *t327*t2057*t557 - t5456 + t5459 - t5462 + t5466 - t5468 - | ^ -Warning: 't2057' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:42: - - 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & - | ^ -note: 't2057' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2725:40: - - 2725 | *t1054*t640*t3679 - | ^ -Warning: 't2054' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:35: - - 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & - | ^ -note: 't2054' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2825:132: - - 2825 | + t6442 + t6451 + t6461 + t6479 + t6490 + t6499 + t6658) - | ^ -Warning: 't2050' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:28: - - 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & - | ^ -note: 't2050' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2829:73: - - 2829 | t43*t46*t6339 + t8*(t6344 + t6380 + t6389 + t6665) - | ^ -Warning: 't2046' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:21: - - 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & - | ^ -note: 't2046' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2764:63: - - 2764 | *t575*t161*t1447 + t5773 + t5776 + t5780 - | ^ -Warning: 't2042' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:311:14: - - 311 | t2042, t2046, t2050, t2054, t2057, t2058, t2061, t207, t2073, t2074, t2077, t2081, t2082, & - | ^ -note: 't2042' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2820:76: - - 2820 | + 0.1666666667e0_dp*t6144 + t6155 - t6158 + (2*t6160) - | ^ -Warning: 't2035' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:97: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1742:88: - 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & - | ^ -note: 't2035' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2810:46: + 1742 | + t712 + 0.2e1_dp*t256 + 0.80e1_dp*t258 + t715)*sc + | ^ +Warning: 't206' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:46: - 2810 | *t60*t2124*t709 - t6044 + 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & | ^ -Warning: 't2032' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:90: +note: 't206' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: - 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc | ^ -note: 't2032' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2743:46: +Warning: 't205' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:40: - 2743 | *t27*t6291*t172 - t5397 - | ^ -Warning: 't2031' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:83: + 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & + | ^ +note: 't205' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2074:32: - 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & - | ^ -note: 't2031' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:666:30: + 2074 | t1580 = t204*t591 + | ^ +Warning: 't204' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1242:27: - 666 | t466 = t27*t203 - | ^ + 1242 | REAL(KIND=dp) :: t204, t2048, t205, t206, t207, t208, t211, t212, t213, t214, t217, t220, & + | ^ +note: 't204' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1737:35: + + 1737 | t709 = 0.2e1_dp*t203 + | ^ Warning: 't203' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:76: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1241:77: - 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & - | ^ + 1241 | t1998, t1999, t2, t20, t2010, t2011, t2014, t2019, t202, t2025, t203 + | ^ note: 't203' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2794:41: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2144:41: - 2794 | *t5228*t2117*t2028 + 2144 | t1764 = 0.2e1_dp*t741*t202 | ^ -Warning: 't2028' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:70: - - 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & - | ^ -note: 't2028' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2778:29: - - 2778 | *t6271 - | ^ -Warning: 't2027' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:63: - - 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & - | ^ -note: 't2027' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: +Warning: 't202' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1241:64: - 2233 | + t5032 + t5035 - | ^ -Warning: 't2022' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:56: + 1241 | t1998, t1999, t2, t20, t2010, t2011, t2014, t2019, t202, t2025, t203 + | ^ +note: 't202' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1508:56: - 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & + 1508 | t55 + t93 + t127)*sc | ^ -note: 't2022' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: - - 2716 | + 0.4500000000e1_dp*t2009*t4744 - | ^ -Warning: 't2018' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:49: - - 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & - | ^ -note: 't2018' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: - - 2716 | + 0.4500000000e1_dp*t2009*t4744 - | ^ -Warning: 't2014' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:42: - - 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & - | ^ -note: 't2014' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: - - 2716 | + 0.4500000000e1_dp*t2009*t4744 - | ^ -Warning: 't2013' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:35: +Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1241:25: - 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & - | ^ -note: 't2013' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: + 1241 | t1998, t1999, t2, t20, t2010, t2011, t2014, t2019, t202, t2025, t203 + | ^ +note: 't2' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: - 2716 | + 0.4500000000e1_dp*t2009*t4744 - | ^ -Warning: 't2009' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:28: + 1900 | *t45*t1020*t984*t1027 + | ^ +Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1240:72: - 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & - | ^ -note: 't2009' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1895:32: + 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & + | ^ +note: 't196' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1592:31: - 1895 | t3875 = t45*t2002 - | ^ -Warning: 't2002' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:310:14: + 1592 | t467 = t195*t393 + | ^ +Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1240:66: - 310 | t2002, t2006, t2009, t2013, t2014, t2018, t2022, t2027, t2028, t203, t2031, t2032, t2035, & - | ^ -note: 't2002' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:777:87: + 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & + | ^ +note: 't195' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1900:44: - 777 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 - | ^ -Warning: 't200' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:80: + 1900 | *t45*t1020*t984*t1027 + | ^ +Warning: 't193' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1240:39: - 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & - | ^ -note: 't200' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1355:31: + 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & + | ^ +note: 't193' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1586:31: - 1355 | t1972 = t177*t20 + 1586 | t455 = t454*t192 | ^ -Warning: 't20' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:74: +Warning: 't192' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1240:33: - 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & - | ^ -note: 't20' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:693:31: + 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & + | ^ +note: 't192' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1588:31: - 693 | t534 = t199*t267 + 1588 | t458 = t191*t457 | ^ -Warning: 't199' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:48: - - 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & - | ^ -note: 't199' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2478:56: - - 2478 | t5722 = 0.1111111111e0_dp*t165*t689*t1988 - | ^ -Warning: 't1988' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:42: - - 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & - | ^ -note: 't1988' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2026:66: - - 2026 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 - | ^ -Warning: 't1981' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:309:21: +Warning: 't191' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1240:27: - 309 | t1980, t1981, t1984, t1987, t1988, t199, t1991, t1994, t1997, t20, t200, t2000, t2001, & - | ^ -note: 't1981' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2357:43: + 1240 | t1901, t1904, t191, t192, t193, t1939, t1945, t1949, t195, t196, t1975, t1979, t1986, & + | ^ +note: 't191' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1585:43: - 2357 | t5421 = t657*t1884*t59*t1975 + 1585 | t450*t385 - t189*t399 | ^ -Warning: 't1975' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:90: +Warning: 't189' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1239:61: - 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & - | ^ -note: 't1975' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2756:70: + 1239 | t1858, t186, t1868, t1870, t1872, t1884, t1886, t189, t1891, t1893, t1894, t1897, t19, & + | ^ +note: 't189' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1733:62: - 2756 | + t5619 + t5622 - t5625 - t5628 + t5631 + t5716 - | ^ -Warning: 't1974' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:83: + 1733 | *t697*t662)*t122) + | ^ +Warning: 't186' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1239:20: - 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & - | ^ -note: 't1974' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: + 1239 | t1858, t186, t1868, t1870, t1872, t1884, t1886, t189, t1891, t1893, t1894, t1897, t19, & + | ^ +note: 't186' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1581:31: - 2716 | + 0.4500000000e1_dp*t2009*t4744 - | ^ -Warning: 't1973' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:76: + 1581 | t447 = t185*t337 + | ^ +Warning: 't185' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1238:80: - 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & - | ^ -note: 't1973' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2631:63: + 1238 | t180, t1804, t1826, t1829, t183, t1832, t1836, t1838, t1839, t184, t185, t1850, t1853, & + | ^ +note: 't185' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1876:39: - 2631 | t6106 = 0.3600000000e2_dp*t1971*t1972*t1973*t672 - | ^ -Warning: 't1972' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:69: + 1876 | *t896 - t189*t914 + | ^ +Warning: 't184' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1238:74: - 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & - | ^ -note: 't1972' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2631:63: + 1238 | t180, t1804, t1826, t1829, t183, t1832, t1836, t1838, t1839, t184, t185, t1850, t1853, & + | ^ +note: 't184' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1392:30: - 2631 | t6106 = 0.3600000000e2_dp*t1971*t1972*t1973*t672 - | ^ -Warning: 't1971' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:62: + 1392 | t156 = t18*t155 + | ^ +Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1237:94: - 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & - | ^ -note: 't1971' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2621:57: + 1237 | t1775, t1776, t1778, t178, t1782, t1783, t1785, t1786, t1789, t179, t1795, t1797, t18, & + | ^ +note: 't18' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1569:31: - 2621 | t6087 = 0.1666666667e0_dp*t429*t1966*t1410 - | ^ -Warning: 't1966' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:48: + 1569 | t424 = t379*t179 + | ^ +Warning: 't179' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1237:75: - 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & - | ^ -note: 't1966' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2305:68: + 1237 | t1775, t1776, t1778, t178, t1782, t1783, t1785, t1786, t1789, t179, t1795, t1797, t18, & + | ^ +note: 't179' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1889:43: - 2305 | *t462*t4729 + 0.3333333334e0_dp*t55*t57*t5276 - | ^ -Warning: 't1962' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:34: + 1889 | t1027 = t865/t432/t178*t1025 + | ^ +Warning: 't178' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1237:34: - 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & + 1237 | t1775, t1776, t1778, t178, t1782, t1783, t1785, t1786, t1789, t179, t1795, t1797, t18, & | ^ -note: 't1962' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:777:87: - - 777 | t200 - 0.5555555558e-1_dp*t192*t729 - 0.5000000001e0_dp*t732*t709 - | ^ -Warning: 't196' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:308:20: - - 308 | t1958, t196, t1961, t1962, t1965, t1966, t1969, t1971, t1972, t1973, t1974, t1975, t1977, & - | ^ -note: 't196' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:688:30: +note: 't178' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1888:30: - 688 | t520 = t195*t25 + 1888 | t1025 = t176**2 | ^ -Warning: 't195' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:82: - - 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & - | ^ -note: 't195' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2042:44: - - 2042 | + (2*t147*t1284*t672) - | ^ -Warning: 't1940' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:62: - - 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & - | ^ -note: 't1940' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:690:36: - - 690 | t527 = t194*t187*t526 - | ^ -Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:55: +Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1236:72: - 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & - | ^ -note: 't194' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: + 1236 | t1701, t172, t1726, t173, t1730, t174, t175, t1750, t1754, t176, t1764, t1765, t1768, & + | ^ +note: 't176' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 2034 | *t1246*t3244*t1483 - | ^ -Warning: 't1932' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:35: + 1917 | *bp*t1020*t984*t1027 + | ^ +Warning: 't175' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1236:52: - 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & - | ^ -note: 't1932' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2641:38: + 1236 | t1701, t172, t1726, t173, t1730, t174, t175, t1750, t1754, t176, t1764, t1765, t1768, & + | ^ +note: 't175' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1568:31: - 2641 | t6138 = t429*t1928*t593 - | ^ -Warning: 't1928' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:307:28: + 1568 | t421 = t174*t393 + | ^ +Warning: 't174' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1236:46: - 307 | REAL(KIND=dp) :: t1928, t1932, t1938, t1939, t194, t1940, t1943, t1946, t195, t1952, t1954, & - | ^ -note: 't1928' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2642:38: + 1236 | t1701, t172, t1726, t173, t1730, t174, t175, t1750, t1754, t176, t1764, t1765, t1768, & + | ^ +note: 't174' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1882:40: - 2642 | t6141 = t658*t575*t1925 - | ^ -Warning: 't1925' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:306:62: + 1882 | t993 = 0.1e1_dp/t427/t172 + | ^ +Warning: 't172' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1236:20: - 306 | t1912, t1914, t1917, t192, t1920, t1923, t1924, t1925 - | ^ -note: 't1925' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2051:58: + 1236 | t1701, t172, t1726, t173, t1730, t174, t175, t1750, t1754, t176, t1764, t1765, t1768, & + | ^ +note: 't172' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1901:48: - 2051 | + 0.3333333334e0_dp*t165*t437*t1688 - | ^ -Warning: 't1924' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:306:55: + 1901 | t1043 = t17**(-0.2333333333e1_dp) + | ^ +Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1235:94: - 306 | t1912, t1914, t1917, t192, t1920, t1923, t1924, t1925 - | ^ -note: 't1924' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2556:38: + 1235 | REAL(KIND=dp) :: t1671, t1672, t1675, t168, t169, t1690, t1694, t1696, t1697, t1698, t17, & + | ^ +note: 't17' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 2556 | t5938 = t192*t728*t1505 - | ^ -Warning: 't192' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:306:34: + 1917 | *bp*t1020*t984*t1027 + | ^ +Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1235:54: - 306 | t1912, t1914, t1917, t192, t1920, t1923, t1924, t1925 - | ^ -note: 't192' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: + 1235 | REAL(KIND=dp) :: t1671, t1672, t1675, t168, t169, t1690, t1694, t1696, t1697, t1698, t17, & + | ^ +note: 't169' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1559:31: - 1923 | t1320*t1483 - | ^ -Warning: 't1912' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:306:14: + 1559 | t403 = t402*t168 + | ^ +Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1235:48: - 306 | t1912, t1914, t1917, t192, t1920, t1923, t1924, t1925 - | ^ -note: 't1912' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: + 1235 | REAL(KIND=dp) :: t1671, t1672, t1675, t168, t169, t1690, t1694, t1696, t1697, t1698, t17, & + | ^ +note: 't168' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1561:31: - 1923 | t1320*t1483 - | ^ -Warning: 't1902' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:81: + 1561 | t407 = t167*t406 + | ^ +Warning: 't167' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1234:75: - 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & - | ^ -note: 't1902' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: + 1234 | t1639, t164, t1653, t1654, t1657, t1659, t1664, t1666, t1668, t167 + | ^ +note: 't167' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1601:54: - 2716 | + 0.4500000000e1_dp*t2009*t4744 + 1601 | t473*t435)*t51 | ^ -Warning: 't19' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:67: +Warning: 't164' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1234:20: - 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & - | ^ -note: 't19' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2456:58: + 1234 | t1639, t164, t1653, t1654, t1657, t1659, t1664, t1666, t1668, t167 + | ^ +note: 't164' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1865:62: - 2456 | t5666 = 0.1125000000e2_dp*t1302*t1892*t1410 - | ^ -Warning: 't1892' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:48: + 1865 | *t394*t874 - 0.9531842928e0_dp*t161*t887 + | ^ +Warning: 't161' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1233:48: - 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & + 1233 | t1603, t1604, t1605, t1606, t1609, t161, t1610, t1611, t1613, t1615, t1620, t1622, t1626, & | ^ -note: 't1892' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:681:30: - - 681 | t503 = t189*t67 - | ^ -Warning: 't189' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:34: - - 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & - | ^ -note: 't189' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2042:44: +note: 't161' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1578:31: - 2042 | + (2*t147*t1284*t672) - | ^ -Warning: 't1886' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:28: + 1578 | t440 = t439*t160 + | ^ +Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1232:87: - 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & - | ^ -note: 't1886' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2709:36: + 1232 | t1570, t1576, t1578, t1580, t1582, t1588, t159, t1590, t1593, t1599, t16, t160, t1602, & + | ^ +note: 't160' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1862:49: - 2709 | t5011 + t5001 - | ^ -Warning: 't1885' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:21: + 1862 | t905 = 0.1817120592e1_dp*t157*t371 + | ^ +Warning: 't157' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1231:93: - 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & - | ^ -note: 't1885' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2357:43: + 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & + | ^ +note: 't157' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 2357 | t5421 = t657*t1884*t59*t1975 + 1917 | *bp*t1020*t984*t1027 | ^ -Warning: 't1884' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:305:14: - - 305 | t1884, t1885, t1886, t189, t1891, t1892, t1895, t1898, t19, t1901, t1902, t1905, t1908, & - | ^ -note: 't1884' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: - - 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 - | ^ -Warning: 't1875' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:304:83: +Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1231:80: - 304 | t1852, t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, & - | ^ -note: 't1875' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:762:30: + 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & + | ^ +note: 't156' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1848:36: - 762 | t707 = t187*t59 - | ^ -Warning: 't187' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:304:62: + 1848 | t870 = t366*t155*t869 + | ^ +Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1231:74: - 304 | t1852, t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, & - | ^ -note: 't187' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2632:58: + 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & + | ^ +note: 't155' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1856:29: - 2632 | t6109 = 0.1666666667e0_dp*t1246*t1962*t1865 - | ^ -Warning: 't1865' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:304:49: + 1856 | t890 = t154**2 + | ^ +Warning: 't154' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1231:68: - 304 | t1852, t1854, t1858, t1861, t1864, t1865, t1868, t187, t1871, t1874, t1875, t1878, t1881, & - | ^ -note: 't1865' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2035:32: + 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & + | ^ +note: 't154' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2018:32: - 2035 | t4498 = t56*t1843 + 2018 | t1383 = t151*t513 | ^ -Warning: 't1843' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:90: - - 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & - | ^ -note: 't1843' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2585:33: +Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1231:20: - 2585 | t6006 = t719*t1838 - | ^ -Warning: 't1838' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:76: + 1231 | t1507, t151, t1510, t1516, t1517, t1522, t1524, t1527, t154, t155, t156, t1567, t157, & + | ^ +note: 't151' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & - | ^ -note: 't1838' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1947:70: + 1917 | *bp*t1020*t984*t1027 + | ^ +Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1230:91: - 1947 | *t508*t1769 - 0.1111111112e0_dp*t192*t1837*t267 - | ^ -Warning: 't1837' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:69: + 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & + | ^ +note: 't150' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1421:30: - 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & - | ^ -note: 't1837' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2542:42: + 1421 | t203 = t15*t202 + | ^ +Warning: 't15' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1230:85: - 2542 | t5908 = t1836*t59*t177*t710 - | ^ -Warning: 't1836' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:62: + 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & + | ^ +note: 't15' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1917:43: - 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & - | ^ -note: 't1836' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: + 1917 | *bp*t1020*t984*t1027 + | ^ +Warning: 't149' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1230:66: - 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 - | ^ -Warning: 't183' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:41: + 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & + | ^ +note: 't149' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1795:90: - 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & - | ^ -note: 't183' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2504:40: + 1795 | + t259 + t715 + t321 + t323 - t325 + t326 + t329)*sc + | ^ +Warning: 't148' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1230:46: - 2504 | t5797 = t1373*t1962*t1829 - | ^ -Warning: 't1829' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:35: + 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & + | ^ +note: 't148' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1919:32: - 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & - | ^ -note: 't1829' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2350:57: + 1919 | t1086 = t147*t479 + | ^ +Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1230:33: - 2350 | t5400 = 0.3333333334e0_dp*t445*t1962*t1825 - | ^ -Warning: 't1825' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:303:21: + 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & + | ^ +note: 't147' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1613:31: - 303 | t1824, t1825, t1828, t1829, t183, t1832, t1835, t1836, t1837, t1838, t1842, t1843, t1849, & - | ^ -note: 't1825' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1975:29: + 1613 | t491 = t144*t254 + | ^ +Warning: 't144' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1230:13: - 1975 | *t3382 - | ^ -Warning: 't1821' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:88: + 1230 | t144, t1455, t1469, t147, t1477, t148, t1480, t1483, t149, t1490, t1493, t15, t150, & + | ^ +note: 't144' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1528:31: - 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & - | ^ -note: 't1821' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: + 1528 | t359 = t143*t340 + | ^ +Warning: 't143' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1229:94: - 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 - | ^ -Warning: 't182' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:81: + 1229 | t1374, t1377, t1380, t1383, t1388, t1389, t1391, t1394, t140, t1404, t141, t142, t143, & + | ^ +note: 't143' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2183:32: - 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & - | ^ -note: 't182' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: + 2183 | t1858 = t802*t142 + | ^ +Warning: 't142' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1229:88: - 1965 | *t478*t183*t3918 - | ^ -Warning: 't1811' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:61: + 1229 | t1374, t1377, t1380, t1383, t1388, t1389, t1391, t1394, t140, t1404, t141, t142, t143, & + | ^ +note: 't142' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2077:32: - 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & - | ^ -note: 't1811' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2508:58: + 2077 | t1590 = t141*t704 + | ^ +Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1229:82: - 2508 | t5810 = 0.1080000000e3_dp*t1143*t1801*t1410 - | ^ -Warning: 't1801' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:33: + 1229 | t1374, t1377, t1380, t1383, t1388, t1389, t1391, t1394, t140, t1404, t141, t142, t143, & + | ^ +note: 't141' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1932:32: - 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & - | ^ -note: 't1801' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2709:36: + 1932 | t1113 = t140*t355 + | ^ +Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1229:69: - 2709 | t5011 + t5001 - | ^ -Warning: 't18' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:302:19: + 1229 | t1374, t1377, t1380, t1383, t1388, t1389, t1391, t1394, t140, t1404, t141, t142, t143, & + | ^ +note: 't140' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1746:31: - 302 | t1797, t18, t1800, t1801, t1804, t1807, t1810, t1811, t1814, t1817, t182, t1821, t1822, & - | ^ -note: 't18' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2560:52: + 1746 | t722 = t343*t137 + | ^ +Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1228:82: - 2560 | t5949 = 0.8999999998e1_dp*t1795*t4909 - | ^ -Warning: 't1795' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:97: + 1228 | REAL(KIND=dp) :: t1346, t1358, t136, t1360, t1361, t1363, t1365, t1368, t137, t1371, t1372, & + | ^ +note: 't137' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2173:33: - 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & - | ^ -note: 't1795' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2568:34: + 2173 | *t725*t371 + | ^ +Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1228:41: - 2568 | t5966 = t1785*t1790 - | ^ -Warning: 't1790' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:83: + 1228 | REAL(KIND=dp) :: t1346, t1358, t136, t1360, t1361, t1363, t1365, t1368, t137, t1371, t1372, & + | ^ +note: 't136' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1780:31: - 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & - | ^ -note: 't1790' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2568:34: + 1780 | t772 = t125*t133 + | ^ +Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1227:56: - 2568 | t5966 = t1785*t1790 - | ^ -Warning: 't1785' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:62: + 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 + | ^ +note: 't133' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1698:31: - 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & - | ^ -note: 't1785' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2615:51: + 1698 | t636 = t635*t131 + | ^ +Warning: 't131' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1227:44: - 2615 | t6078 = 0.1111111112e0_dp*t719*t1782 - | ^ -Warning: 't1782' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:48: + 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 + | ^ +note: 't131' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1844:40: - 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & - | ^ -note: 't1782' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2584:38: + 1844 | t864 = 0.1e1_dp/t370/t130 + | ^ +Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1227:38: - 2584 | t6004 = t1709*t178*t710 + 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 | ^ -Warning: 't178' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:41: - - 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & - | ^ -note: 't178' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2586:52: +note: 't130' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1486:30: - 2586 | t6009 = 0.5000000001e0_dp*t1777*t4908 - | ^ -Warning: 't1777' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:28: + 1486 | t306 = t13*t305 + | ^ +Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1227:32: - 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & - | ^ -note: 't1777' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2578:52: + 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 + | ^ +note: 't13' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:2173:33: - 2578 | t5985 = 0.5000000001e0_dp*t1774*t4908 - | ^ -Warning: 't1774' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:301:14: + 2173 | *t725*t371 + | ^ +Warning: 't129' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1227:20: - 301 | t1774, t1776, t1777, t1779, t178, t1782, t1784, t1785, t1787, t1789, t1790, t1794, t1795, & - | ^ -note: 't1774' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:763:31: + 1227 | t1284, t129, t1299, t13, t130, t131, t132, t133, t1341, t1344 + | ^ +note: 't129' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1508:56: - 763 | t708 = t707*t177 - | ^ -Warning: 't177' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:89: + 1508 | t55 + t93 + t127)*sc + | ^ +Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1226:94: - 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & - | ^ -note: 't177' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2536:33: + 1226 | t1211, t1218, t122, t1221, t1235, t1238, t1244, t1245, t125, t1250, t1252, t126, t127, & + | ^ +note: 't127' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1456:31: - 2536 | t5885 = t719*t1769 - | ^ -Warning: 't1769' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:83: + 1456 | t257 = t126*t133 + | ^ +Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1226:88: - 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & - | ^ -note: 't1769' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2610:40: + 1226 | t1211, t1218, t122, t1221, t1235, t1238, t1244, t1245, t125, t1250, t1252, t126, t127, & + | ^ +note: 't126' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1780:31: - 2610 | t6060 = t1766*t5881*t4940 - | ^ -Warning: 't1766' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:69: + 1780 | t772 = t125*t133 + | ^ +Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1226:68: - 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & - | ^ -note: 't1766' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2603:52: + 1226 | t1211, t1218, t122, t1221, t1235, t1238, t1244, t1245, t125, t1250, t1252, t126, t127, & + | ^ +note: 't125' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1733:62: - 2603 | t6044 = 0.2000000002e1_dp*t1763*t5956 - | ^ -Warning: 't1763' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:55: + 1733 | *t697*t662)*t122) + | ^ +Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1226:27: - 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & - | ^ -note: 't1763' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:950:30: + 1226 | t1211, t1218, t122, t1221, t1235, t1238, t1244, t1245, t125, t1250, t1252, t126, t127, & + | ^ +note: 't122' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1381:30: - 950 | t1140 = t176**2 + 1381 | t141 = t140*t12 | ^ -Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:300:34: - - 300 | REAL(KIND=dp) :: t1758, t176, t1760, t1762, t1763, t1765, t1766, t1768, t1769, t177, t1773, & - | ^ -note: 't176' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: +Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1225:74: - 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 - | ^ -Warning: 't1755' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:70: + 1225 | t1154, t1157, t116, t1160, t1165, t1166, t1168, t1171, t1181, t12, t120, t1205, t1208, & + | ^ +note: 't12' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1481:31: - 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 - | ^ -note: 't1755' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2597:72: + 1481 | t297 = t116*t277 + | ^ +Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1225:27: - 2597 | *t6021 + t6025 - 0.5555555558e-1_dp*t58*t5613*t71 - | ^ -Warning: 't1748' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:49: + 1225 | t1154, t1157, t116, t1160, t1165, t1166, t1168, t1171, t1181, t12, t120, t1205, t1208, & + | ^ +note: 't116' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1477:31: - 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 - | ^ -note: 't1748' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: + 1477 | t291 = t111*t264 + | ^ +Warning: 't111' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1223:72: - 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 - | ^ -Warning: 't1745' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:42: + 1223 | t1089, t109, t1094, t1096, t1099, t11, t110, t1108, t1109, t111, t1110, t1111, t1113, & + | ^ +note: 't111' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1972:41: - 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 - | ^ -note: 't1745' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2562:52: + 1972 | t1299 = t110**(-0.40e1_dp) + | ^ +Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1223:52: - 2562 | t5954 = 0.8999999998e1_dp*t1741*t4909 + 1223 | t1089, t109, t1094, t1096, t1099, t11, t110, t1108, t1109, t111, t1110, t1111, t1113, & | ^ -Warning: 't1741' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:28: - - 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 - | ^ -note: 't1741' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2554:57: +note: 't110' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1526:30: - 2554 | t5929 = 0.2250000000e2_dp*t1740*t471*t4905 - | ^ -Warning: 't1740' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:21: + 1526 | t356 = t11*t355 + | ^ +Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1223:46: - 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 - | ^ -note: 't1740' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: + 1223 | t1089, t109, t1094, t1096, t1099, t11, t110, t1108, t1109, t111, t1110, t1111, t1113, & + | ^ +note: 't11' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1733:62: - 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 - | ^ -Warning: 't1737' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:299:14: + 1733 | *t697*t662)*t122) + | ^ +Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1223:20: - 299 | t1737, t1740, t1741, t1743, t1745, t1748, t1752, t1754, t1755, t1757 - | ^ -note: 't1737' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2003:32: + 1223 | t1089, t109, t1094, t1096, t1099, t11, t110, t1108, t1109, t111, t1110, t1111, t1113, & + | ^ +note: 't109' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1706:40: - 2003 | t4352 = t1731*t67 - | ^ -Warning: 't1731' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:90: + 1706 | t656 = 0.1e1_dp/t654/t101 + | ^ +Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1221:90: - 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & + 1221 | REAL(KIND=dp) :: ap, bp, cp, d2f0, myrho, myrhoa, myrhob, Qa, Qf, Qp, t1, t100, t101, t1010, & | ^ -note: 't1731' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2588:52: - - 2588 | t6019 = 0.7407407410e-1_dp*t719*t1726 - | ^ -Warning: 't1726' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:69: - - 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & - | ^ -note: 't1726' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2620:37: - - 2620 | *t6075 - t6078 - | ^ -Warning: 't1722' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:55: +note: 't101' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1376:29: - 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & - | ^ -note: 't1722' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2611:52: + 1376 | t132 = t1*t131 + | ^ +Warning: 't1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1221:78: - 2611 | t6063 = 0.1000000000e1_dp*t1720*t5956 - | ^ -Warning: 't1720' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:48: + 1221 | REAL(KIND=dp) :: ap, bp, cp, d2f0, myrho, myrhoa, myrhob, Qa, Qf, Qp, t1, t100, t101, t1010, & + | ^ +note: 't1' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1023:48: - 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & + 1023 | t540 = 0.1817120592e1_dp*t98*t221 | ^ -note: 't1720' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:782:70: - - 782 | *t165*t462*t561 + 0.3333333334e0_dp*t55*t57*t735 - | ^ -Warning: 't172' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:41: - - 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & - | ^ -note: 't172' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2540:56: - - 2540 | t5902 = 0.1800000000e2_dp*t1718*t178*t710 - | ^ -Warning: 't1718' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:28: +Warning: 't98' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:685:62: - 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & - | ^ -note: 't1718' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2567:34: + 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p + | ^ +note: 't98' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 2567 | t5964 = t1715*t1525 - | ^ -Warning: 't1715' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:298:14: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't97' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:685:57: - 298 | t1715, t1717, t1718, t1719, t172, t1720, t1722, t1724, t1726, t1728, t1730, t1731, t1735, & - | ^ -note: 't1715' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: + 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p + | ^ +note: 't97' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:884:30: - 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 - | ^ -Warning: 't1712' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:87: + 884 | t291 = t124*t96 + | ^ +Warning: 't96' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:685:46: - 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & - | ^ -note: 't1712' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:707:26: + 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p + | ^ +note: 't96' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1017:28: - 707 | t537 - | ^ -Warning: 't171' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:80: + 1017 | t525 = t95**2 + | ^ +Warning: 't95' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:685:23: - 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & - | ^ -note: 't171' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2584:38: + 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p + | ^ +note: 't95' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:924:30: - 2584 | t6004 = t1709*t178*t710 - | ^ -Warning: 't1709' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:74: + 924 | t357 = t92*t165 + | ^ +Warning: 't92' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:685:12: - 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & - | ^ -note: 't1709' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: + 685 | t92, t947, t95, t950, t953, t956, t96, t967, t97, t98, t984, t986, t990, x0p + | ^ +note: 't92' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:870:30: - 2087 | *t83*t45*t3581*t140 - | ^ -Warning: 't1706' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:60: + 870 | t261 = t260*t91 + | ^ +Warning: 't91' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:684:97: - 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & - | ^ -note: 't1706' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1893:39: + 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & + | ^ +note: 't91' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1005:39: - 1893 | *t165*t3865*t237 + 1005 | t499 = 0.1e1_dp/t220/t90 | ^ -Warning: 't1703' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:46: - - 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & - | ^ -note: 't1703' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: - - 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 - | ^ -Warning: 't1700' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:32: - - 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & - | ^ -note: 't1700' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2483:61: - - 2483 | t5738 = 0.4444444445e0_dp*t170*t114*t4782*t451 - | ^ -Warning: 't170' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:25: +Warning: 't90' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:684:92: - 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & - | ^ -note: 't170' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:707:26: + 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & + | ^ +note: 't90' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 707 | t537 - | ^ -Warning: 't17' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:297:19: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't89' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:684:87: - 297 | t1699, t17, t170, t1700, t1702, t1703, t1705, t1706, t1708, t1709, t171, t1712, t1714, & - | ^ -note: 't17' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: + 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & + | ^ +note: 't89' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:923:30: - 2087 | *t83*t45*t3581*t140 - | ^ -Warning: 't1694' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:84: + 923 | t356 = t88*t160 + | ^ +Warning: 't88' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:684:82: - 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & - | ^ -note: 't1694' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: + 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & + | ^ +note: 't88' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:836:75: - 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 - | ^ -Warning: 't1689' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:70: + 836 | e_b(ip) = e_b(ip) + ((t144 + t213 + t203)*t2 + t42 + t86)*sc + | ^ +Warning: 't86' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:684:53: - 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & - | ^ -note: 't1689' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2654:37: + 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & + | ^ +note: 't86' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:799:30: - 2654 | t6175 = t83*t597*t1688 - | ^ -Warning: 't1688' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:63: + 799 | t155 = t154*t85 + | ^ +Warning: 't85' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:684:36: - 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & - | ^ -note: 't1688' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2419:33: + 684 | t835, t836, t838, t841, t85, t851, t853, t86, t860, t863, t872, t879, t88, t89, t90, t91, & + | ^ +note: 't85' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:972:67: - 2419 | t5565 = t112*t1685 - | ^ -Warning: 't1685' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:56: + 972 | *t443*t408)*t80) - t332 + | ^ +Warning: 't80' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:683:44: - 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & - | ^ -note: 't1685' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2403:43: + 683 | REAL(KIND=dp) :: t792, t793, t798, t80, t800, t804, t807, t808, t810, t814, t820, t823, & + | ^ +note: 't80' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:822:30: - 2403 | t5528 = t102*t327*t1684*t557 - | ^ -Warning: 't1684' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:49: + 822 | t193 = t74*t173 + | ^ +Warning: 't74' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:682:18: - 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & - | ^ -note: 't1684' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2392:38: + 682 | t732, t74, t743, t745, t748, t752, t755, t758, t769, t78 + | ^ +note: 't74' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:818:30: - 2392 | t5496 = t366*t368*t1681 - | ^ -Warning: 't1681' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:42: + 818 | t187 = t69*t160 + | ^ +Warning: 't69' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:681:28: - 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & - | ^ -note: 't1681' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2397:38: + 681 | t665, t67, t68, t69, t690, t693, t696, t7, t705, t71, t710, t719, t720, t721, t727, t729, & + | ^ +note: 't69' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1090:39: - 2397 | t5511 = t1680*t3673*t23 - | ^ -Warning: 't1680' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:35: + 1090 | t769 = t68**(-0.40e1_dp) + | ^ +Warning: 't68' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:681:23: - 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & - | ^ -note: 't1680' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2391:49: + 681 | t665, t67, t68, t69, t690, t693, t696, t7, t705, t71, t710, t719, t720, t721, t727, t729, & + | ^ +note: 't68' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:972:67: - 2391 | t5494 = 0.6400000000e2_dp*t7*t1677 - | ^ -Warning: 't1677' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:296:21: + 972 | *t443*t408)*t80) - t332 + | ^ +Warning: 't67' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:681:18: - 296 | t1675, t1677, t1679, t1680, t1681, t1684, t1685, t1688, t1689, t1693, t1694, t1696, & - | ^ -note: 't1677' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2393:44: + 681 | t665, t67, t68, t69, t690, t693, t696, t7, t705, t71, t710, t719, t720, t721, t727, t729, & + | ^ +note: 't67' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:945:39: - 2393 | t5499 = 0.120e2_dp*t550*t1669 - | ^ -Warning: 't1669' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:89: + 945 | t402 = 0.1e1_dp/t400/t59 + | ^ +Warning: 't59' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:680:47: - 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & - | ^ -note: 't1669' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2395:52: + 680 | t567, t570, t573, t58, t583, t589, t59, t595, t596, t6, t601, t603, t613, t62, t625, t64, & + | ^ +note: 't59' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:800:29: - 2395 | t5507 = 0.120e2_dp*t7*t640*t1667*t371 - | ^ -Warning: 't1667' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:82: + 800 | t156 = t88*t55 + | ^ +Warning: 't55' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:679:77: - 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & - | ^ -note: 't1667' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:707:26: + 679 | t522, t525, t526, t528, t531, t536, t538, t54, t540, t541, t549, t55, t559, t563, t565, & + | ^ +note: 't55' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:826:26: - 707 | t537 + 826 | t144 | ^ -Warning: 't166' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:54: +Warning: 't54' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:679:54: - 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & + 679 | t522, t525, t526, t528, t531, t536, t538, t54, t540, t541, t549, t55, t559, t563, t565, & | ^ -note: 't166' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2389:52: +note: 't54' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:827:30: + + 827 | t203 = t51*t202 + | ^ +Warning: 't51' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:678:70: + + 678 | t494, t497, t499, t5, t500, t501, t504, t505, t508, t509, t51, t510, t513, t516, t519, & + | ^ +note: 't51' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:764:27: - 2389 | t5489 = 0.1600000000e2_dp*t1429*t1658 - | ^ -Warning: 't1658' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:48: + 764 | t97 = t5*t96 + | ^ +Warning: 't5' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:678:29: - 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & - | ^ -note: 't1658' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2388:54: + 678 | t494, t497, t499, t5, t500, t501, t504, t505, t508, t509, t51, t510, t513, t516, t519, & + | ^ +note: 't5' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1165:106: - 2388 | t5487 = 0.2160000000e3_dp*t7*t995*t1652 - | ^ -Warning: 't1652' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:27: + 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc + | ^ +Warning: 't490' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:95: - 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & - | ^ -note: 't1652' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2499:57: + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & + | ^ +note: 't490' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - 2499 | t5783 = 0.5555555557e-1_dp*t165*t5013*t433 - | ^ -Warning: 't165' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:295:20: + 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc + | ^ +Warning: 't489' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:84: - 295 | t1649, t165, t1652, t1654, t1656, t1658, t166, t1660, t1662, t1664, t1667, t1669, t1671, & - | ^ -note: 't165' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2161:56: + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & + | ^ +note: 't489' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1167:32: - 2161 | t102*t4838 - 0.20e1_dp*t102*t4850 - | ^ -Warning: 't1645' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:90: + 1167 | t1019 = t488*t202 + | ^ +Warning: 't488' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:78: - 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & - | ^ -note: 't1645' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2386:49: + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & + | ^ +note: 't488' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - 2386 | t5482 = 0.2160000000e3_dp*t7*t1642 - | ^ -Warning: 't1642' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:76: + 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc + | ^ +Warning: 't485' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:72: - 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & - | ^ -note: 't1642' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & + | ^ +note: 't485' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 + 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc + | ^ +Warning: 't482' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:66: + + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & | ^ -Warning: 't1640' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:69: +note: 't482' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1083:47: - 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & - | ^ -note: 't1640' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:660:31: + 1083 | t732 = t48**(-0.1666666667e1_dp) + | ^ +Warning: 't48' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:60: - 660 | t445 = t164*t444 - | ^ -Warning: 't164' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:62: + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & + | ^ +note: 't48' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & - | ^ -note: 't164' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2405:44: + 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc + | ^ +Warning: 't479' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:55: - 2405 | t5533 = 0.160e2_dp*t112*t1632 - | ^ -Warning: 't1632' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:35: + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & + | ^ +note: 't479' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & - | ^ -note: 't1632' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc + | ^ +Warning: 't475' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:49: - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't1631' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:294:28: + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & + | ^ +note: 't475' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - 294 | t1628, t1630, t1631, t1632, t1634, t1636, t1638, t164, t1640, t1642, t1644, t1645, t1647, & - | ^ -note: 't1631' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2404:44: + 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc + | ^ +Warning: 't472' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:43: - 2404 | t5531 = 0.160e2_dp*t112*t1626 - | ^ -Warning: 't1626' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:91: + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & + | ^ +note: 't472' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1158:35: - 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & - | ^ -note: 't1626' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: + 1158 | t990 = 0.2e1_dp*t471 + | ^ +Warning: 't471' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:37: - 1857 | *t321*t953*t1625 - | ^ -Warning: 't1625' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:84: + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & + | ^ +note: 't471' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1156:40: - 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & - | ^ -note: 't1625' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2407:44: + 1156 | t984 = 0.2e1_dp*t470*t202 + | ^ +Warning: 't470' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:31: - 2407 | t5537 = 0.160e2_dp*t112*t1622 - | ^ -Warning: 't1622' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:70: + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & + | ^ +note: 't470' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: - 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & - | ^ -note: 't1622' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: + 1176 | + t489)*sc + | ^ +Warning: 't467' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:25: - 1857 | *t321*t953*t1625 - | ^ -Warning: 't1621' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:63: + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & + | ^ +note: 't467' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: - 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & - | ^ -note: 't1621' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2370:47: + 1176 | + t489)*sc + | ^ +Warning: 't464' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:19: - 2370 | t5446 = 0.480e2_dp*t24*t23*t1618 - | ^ -Warning: 't1618' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:49: + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & + | ^ +note: 't464' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: - 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & - | ^ -note: 't1618' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: + 1176 | + t489)*sc + | ^ +Warning: 't461' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:677:13: - 1857 | *t321*t953*t1625 - | ^ -Warning: 't1617' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:42: + 677 | t461, t464, t467, t470, t471, t472, t475, t479, t48, t482, t485, t488, t489, t49, t490, & + | ^ +note: 't461' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: - 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & - | ^ -note: 't1617' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: + 1176 | + t489)*sc + | ^ +Warning: 't458' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:91: - 1865 | *t339*t969 - | ^ -Warning: 't1616' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:293:35: + 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & + | ^ +note: 't458' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1147:35: - 293 | REAL(KIND=dp) :: t1615, t1616, t1617, t1618, t1620, t1621, t1622, t1624, t1625, t1626, & + 1147 | t956 = 0.3e1_dp*t452 | ^ -note: 't1616' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2402:51: +Warning: 't452' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:73: - 2402 | t5525 = 0.2133333334e2_dp*t339*t1611 - | ^ -Warning: 't1611' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:69: + 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & + | ^ +note: 't452' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1157:31: - 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 - | ^ -note: 't1611' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1441:46: + 1157 | t986 = t212*t451 + | ^ +Warning: 't451' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:67: - 1441 | - t1994 + t1997 - t2000 - | ^ -Warning: 't161' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:55: + 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & + | ^ +note: 't451' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1080:47: - 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 - | ^ -note: 't161' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2383:51: + 1080 | t721 = t45**(-0.1666666667e1_dp) + | ^ +Warning: 't45' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:61: - 2383 | t5474 = 0.4266666668e2_dp*t339*t1608 - | ^ -Warning: 't1608' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:49: + 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & + | ^ +note: 't45' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 - | ^ -note: 't1608' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2372:44: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't443' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:56: - 2372 | t5451 = 0.640e2_dp*t605*t1603 - | ^ -Warning: 't1603' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:28: + 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & + | ^ +note: 't443' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 - | ^ -note: 't1603' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't442' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:50: - 1831 | *t3339 - | ^ -Warning: 't1602' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:292:21: + 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & + | ^ +note: 't442' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 292 | t1601, t1602, t1603, t1605, t1607, t1608, t161, t1610, t1611, t1613 - | ^ -note: 't1602' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:641:31: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't437' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:39: - 641 | t394 = t393*t160 - | ^ -Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:95: + 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & + | ^ +note: 't437' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & - | ^ -note: 't160' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1080:46: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't434' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:33: - 1080 | t1439 = 0.1e1_dp/t787/t16*t1438 - | ^ -Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:89: + 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & + | ^ +note: 't434' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & - | ^ -note: 't16' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2413:49: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't433' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:676:27: - 2413 | t5551 = 0.1280e3_dp*t24*t298*t1599 - | ^ -Warning: 't1599' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:84: + 676 | REAL(KIND=dp) :: t433, t434, t437, t44, t442, t443, t45, t451, t452, t455, t457, t458, t46, & + | ^ +note: 't433' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:794:29: - 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & - | ^ -note: 't1599' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + 794 | t146 = t43*t91 + | ^ +Warning: 't43' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:71: - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't1598' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:77: + 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 + | ^ +note: 't43' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & - | ^ -note: 't1598' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1871:70: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't429' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:66: - 1871 | *t1582*t801 - 0.2133333334e2_dp*t321*t953*t1631 - | ^ -Warning: 't1597' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:70: + 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 + | ^ +note: 't429' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & - | ^ -note: 't1597' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2416:52: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't428' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:60: - 2416 | t5560 = 0.2346666666e3_dp*t1589*t1592 - | ^ -Warning: 't1592' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:49: + 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 + | ^ +note: 't428' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & - | ^ -note: 't1592' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1865:33: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't427' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:54: - 1865 | *t339*t969 - | ^ -Warning: 't1589' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:291:35: + 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 + | ^ +note: 't427' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 291 | t1584, t1586, t1588, t1589, t1591, t1592, t1594, t1596, t1597, t1598, t1599, t16, t160, & - | ^ -note: 't1589' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2374:46: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't425' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:48: - 2374 | t5456 = 0.1280e3_dp*t1582*t1426 - | ^ -Warning: 't1582' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:91: + 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 + | ^ +note: 't425' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & - | ^ -note: 't1582' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2087:42: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't424' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:42: - 2087 | *t83*t45*t3581*t140 + 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 | ^ -Warning: 't1575' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:63: +note: 't424' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1114:39: - 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & - | ^ -note: 't1575' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2652:56: + 1114 | *t841 - t187*t851 + | ^ +Warning: 't420' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:36: - 2652 | t6170 = 0.3333333336e0_dp*t289*t597*t1571 - | ^ -Warning: 't1571' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:49: + 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 + | ^ +note: 't420' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:836:75: - 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & - | ^ -note: 't1571' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1893:39: + 836 | e_b(ip) = e_b(ip) + ((t144 + t213 + t203)*t2 + t42 + t86)*sc + | ^ +Warning: 't42' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:30: - 1893 | *t165*t3865*t237 + 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 + | ^ +note: 't42' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1114:39: + + 1114 | *t841 - t187*t851 | ^ -Warning: 't1568' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:35: +Warning: 't413' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:25: - 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & - | ^ -note: 't1568' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1893:39: + 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 + | ^ +note: 't413' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1114:39: - 1893 | *t165*t3865*t237 + 1114 | *t841 - t187*t851 | ^ -Warning: 't1565' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:28: +Warning: 't412' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:675:19: - 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & - | ^ -note: 't1565' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2656:38: + 675 | t408, t412, t413, t42, t420, t424, t425, t427, t428, t429, t43 + | ^ +note: 't412' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1089:31: - 2656 | t6181 = t289*t1564*t593 - | ^ -Warning: 't1564' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:290:21: + 1089 | t758 = t509*t407 + | ^ +Warning: 't407' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:95: - 290 | t1563, t1564, t1565, t1568, t1570, t1571, t1574, t1575, t1577, t1579, t1581, t1582, & - | ^ -note: 't1564' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1633:65: + 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & + | ^ +note: 't407' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1094:41: - 1633 | *t2869 - 0.6000000000e1_dp*t405*t2873*t237 - | ^ -Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:89: + 1094 | t800 = t500/t405/t178*t798 + | ^ +Warning: 't405' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:89: - 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & + 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & | ^ -note: 't156' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2666:56: +note: 't405' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 2666 | t6201 = 0.3333333336e0_dp*t289*t597*t1557 - | ^ -Warning: 't1557' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:83: + 1144 | *t389*t573*t748 + | ^ +Warning: 't404' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:83: - 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & + 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & | ^ -note: 't1557' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2657:56: - - 2657 | t6185 = 0.3333333336e0_dp*t289*t597*t1553 - | ^ -Warning: 't1553' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:69: - - 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & - | ^ -note: 't1553' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1621:39: +note: 't404' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 1621 | *t400*t401*t2230 - | ^ -Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:55: + 1144 | *t389*t573*t748 + | ^ +Warning: 't403' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:77: - 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & - | ^ -note: 't155' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1879:71: + 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & + | ^ +note: 't403' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1116:35: - 1879 | *t1694*t804 + 0.1666666668e0_dp*t1546*t897*t3314 - | ^ -Warning: 't1547' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:42: + 1116 | t863 = 0.1e1_dp/t400 + | ^ +Warning: 't400' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:65: - 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & - | ^ -note: 't1547' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: + 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & + | ^ +note: 't400' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1039:46: - 2079 | *t289*t294*t1553 - | ^ -Warning: 't1546' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:289:35: + 1039 | t613 = t4**(-0.2333333333e1_dp) + | ^ +Warning: 't4' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:59: - 289 | t1541, t1543, t1545, t1546, t1547, t1549, t155, t1552, t1553, t1556, t1557, t156, t1560, & - | ^ -note: 't1546' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: + 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & + | ^ +note: 't4' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 2098 | t3869 + t4657 + t4696) - | ^ -Warning: 't1536' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:91: + 1144 | *t389*t573*t748 + | ^ +Warning: 't394' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:49: - 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & - | ^ -note: 't1536' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2164:42: + 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & + | ^ +note: 't394' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 2164 | t4864 = t217*t46*t1535*t561 - | ^ -Warning: 't1535' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:84: + 1144 | *t389*t573*t748 + | ^ +Warning: 't390' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:37: - 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & - | ^ -note: 't1535' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: + 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & + | ^ +note: 't390' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 - | ^ -Warning: 't1531' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:77: + 1144 | *t389*t573*t748 + | ^ +Warning: 't389' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:31: - 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & - | ^ -note: 't1531' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2192:52: + 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & + | ^ +note: 't389' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 2192 | t4932 = 0.5000000001e0_dp*t1528*t4908 - | ^ -Warning: 't1528' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:63: + 1144 | *t389*t573*t748 + | ^ +Warning: 't382' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:19: - 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & - | ^ -note: 't1528' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2200:33: + 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & + | ^ +note: 't382' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 2200 | t4952 = t719*t1525 - | ^ -Warning: 't1525' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:56: + 1144 | *t389*t573*t748 + | ^ +Warning: 't381' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:674:13: - 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & - | ^ -note: 't1525' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2612:42: + 674 | t381, t382, t388, t389, t390, t391, t394, t397, t4, t400, t402, t403, t404, t405, t407, & + | ^ +note: 't381' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 2612 | t6066 = t1519*t705*t561*t65 - | ^ -Warning: 't1519' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:42: + 1144 | *t389*t573*t748 + | ^ +Warning: 't380' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:95: - 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & - | ^ -note: 't1519' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2589:39: + 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & + | ^ +note: 't380' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:908:60: - 2589 | t6021 = t649*t1518*t1722 - | ^ -Warning: 't1518' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:35: + 908 | *t325*t287)*t38) + | ^ +Warning: 't38' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:89: - 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & - | ^ -note: 't1518' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2190:52: + 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & + | ^ +note: 't38' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 2190 | t4925 = 0.5000000001e0_dp*t1513*t4908 - | ^ -Warning: 't1513' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:288:14: + 1144 | *t389*t573*t748 + | ^ +Warning: 't377' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:84: - 288 | t1513, t1515, t1517, t1518, t1519, t1523, t1525, t1528, t1530, t1531, t1535, t1536, & - | ^ -note: 't1513' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: + 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & + | ^ +note: 't377' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 1983 | t192*t68*t4256*t65 - | ^ -Warning: 't1510' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:87: + 1144 | *t389*t573*t748 + | ^ +Warning: 't376' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:78: - 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & - | ^ -note: 't1510' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1395:80: + 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & + | ^ +note: 't376' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 1395 | + t1482 + t1479 - t1489 + 0.3333333334e0_dp*t55*t57*t2042 - | ^ -Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:80: + 1144 | *t389*t573*t748 + | ^ +Warning: 't373' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:72: - 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & - | ^ -note: 't151' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2184:52: + 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & + | ^ +note: 't373' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1107:62: - 2184 | t4911 = 0.8999999998e1_dp*t1507*t4909 - | ^ -Warning: 't1507' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:67: + 1107 | *t368*t509 - 0.9531842928e0_dp*t162*t522 + | ^ +Warning: 't368' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:66: - 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & - | ^ -note: 't1507' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2181:57: + 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & + | ^ +note: 't368' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1099:30: - 2181 | t4907 = 0.2250000000e2_dp*t1506*t471*t4905 - | ^ -Warning: 't1506' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:60: + 1099 | t814 = t92*t365 + | ^ +Warning: 't365' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:60: - 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & + 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & | ^ -note: 't1506' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2556:38: - - 2556 | t5938 = t192*t728*t1505 - | ^ -Warning: 't1505' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:53: - - 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & - | ^ -note: 't1505' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2606:37: +note: 't365' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 2606 | t6052 = t1504*t561*t65 + 1144 | *t389*t573*t748 | ^ -Warning: 't1504' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:46: +Warning: 't364' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:54: - 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & - | ^ -note: 't1504' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2174:39: + 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & + | ^ +note: 't364' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 2174 | t4895 = t478*t1500*t4729 - | ^ -Warning: 't1500' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:32: + 1144 | *t389*t573*t748 + | ^ +Warning: 't363' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:48: - 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & - | ^ -note: 't1500' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1744:85: + 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & + | ^ +note: 't363' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 1744 | + t3288) - | ^ -Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:287:25: + 1144 | *t389*t573*t748 + | ^ +Warning: 't357' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:37: - 287 | t1498, t15, t150, t1500, t1502, t1504, t1505, t1506, t1507, t1509, t151, t1510, t1512, & - | ^ -note: 't150' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2171:57: + 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & + | ^ +note: 't357' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 2171 | t4887 = 0.1800000000e2_dp*t473*t1493*t4729 - | ^ -Warning: 't1493' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:286:90: + 1144 | *t389*t573*t748 + | ^ +Warning: 't356' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:31: - 286 | REAL(KIND=dp) :: t1471, t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, & - | ^ -note: 't1493' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:570:31: + 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & + | ^ +note: 't356' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1098:31: - 570 | t250 = t149*t249 + 1098 | t810 = t353*t509 | ^ -Warning: 't149' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:286:76: +Warning: 't353' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:19: - 286 | REAL(KIND=dp) :: t1471, t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, & - | ^ -note: 't149' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2633:59: + 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & + | ^ +note: 't353' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: - 2633 | t6112 = 0.5555555556e-1_dp*t1246*t4553*t1483 - | ^ -Warning: 't1483' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:286:56: + 1176 | + t489)*sc + | ^ +Warning: 't352' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:673:13: - 286 | REAL(KIND=dp) :: t1471, t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, & - | ^ -note: 't1483' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: + 673 | t352, t353, t354, t356, t357, t36, t363, t364, t365, t368, t373, t376, t377, t38, t380, & + | ^ +note: 't352' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1165:106: - 2233 | + t5032 + t5035 - | ^ -Warning: 't1471' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:286:28: + 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc + | ^ +Warning: 't351' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:96: - 286 | REAL(KIND=dp) :: t1471, t1476, t1479, t1482, t1483, t1485, t1489, t149, t1492, t1493, t1496, & - | ^ -note: 't1471' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1783:38: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't351' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1165:106: - 1783 | t165*t171*t3449 - | ^ -Warning: 't1470' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:74: + 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc + | ^ +Warning: 't350' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:90: - 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 - | ^ -note: 't1470' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't350' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1084:31: - 2233 | + t5032 + t5035 - | ^ -Warning: 't1466' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:61: + 1084 | t743 = t349*t202 + | ^ +Warning: 't349' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:84: - 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 - | ^ -note: 't1466' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2233:38: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't349' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1165:106: - 2233 | + t5032 + t5035 - | ^ -Warning: 't1459' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:48: + 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc + | ^ +Warning: 't346' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:78: - 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 - | ^ -note: 't1459' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2786:32: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't346' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1153:89: - 2786 | t6557 = t1447*t59 - | ^ -Warning: 't1447' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:21: + 1153 | + t953 + 0.3e1_dp*t350 + 0.6e1_dp*t351 + t956)*sc + | ^ +Warning: 't343' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:72: - 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 - | ^ -note: 't1447' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2406:45: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't343' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - 2406 | t5535 = 0.640e2_dp*t1582*t1444 - | ^ -Warning: 't1444' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:285:14: + 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc + | ^ +Warning: 't342' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:66: - 285 | t1444, t1447, t145, t1451, t1455, t1459, t146, t1466, t147, t1470 - | ^ -note: 't1444' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2425:53: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't342' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1165:106: - 2425 | t5579 = 0.80e1_dp*t102*t327*t645*t1443 - | ^ -Warning: 't1443' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:97: + 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc + | ^ +Warning: 't339' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:60: - 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & - | ^ -note: 't1443' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2155:59: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't339' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1165:106: - 2155 | - 0.2400000000e2_dp*t786/t2492*t1058 - | ^ -Warning: 't1440' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:90: + 1165 | + t950)*t2 + t953 + t350 + 0.4e1_dp*t351 + t956 + t990 + t490)*sc + | ^ +Warning: 't337' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:54: - 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & - | ^ -note: 't1440' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2079:39: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't337' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1153:89: - 2079 | *t289*t294*t1553 - | ^ -Warning: 't144' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:83: + 1153 | + t953 + 0.3e1_dp*t350 + 0.6e1_dp*t351 + t956)*sc + | ^ +Warning: 't334' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:48: - 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & - | ^ -note: 't144' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1842:34: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't334' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - 1842 | t3679 = t2565*t1439 - | ^ -Warning: 't1439' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:77: + 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc + | ^ +Warning: 't333' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:42: - 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & - | ^ -note: 't1439' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2252:66: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't333' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1146:35: - 2252 | *t7*t640*t635*t371 + 0.180e2_dp*t5115*t1681 - | ^ -Warning: 't1438' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:70: + 1146 | t953 = 0.3e1_dp*t332 + | ^ +Warning: 't332' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:36: - 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & - | ^ -note: 't1438' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't332' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - 1850 | *t786*t1034*t1681 - | ^ -Warning: 't1429' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:56: + 1062 | t133*t10 + 0.2e1_dp*t307*t105 + | ^ +Warning: 't325' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:30: - 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & - | ^ -note: 't1429' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2374:46: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't325' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - 2374 | t5456 = 0.1280e3_dp*t1582*t1426 - | ^ -Warning: 't1426' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:49: + 1062 | t133*t10 + 0.2e1_dp*t307*t105 + | ^ +Warning: 't324' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:24: - 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & - | ^ -note: 't1426' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2384:55: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't324' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:789:30: - 2384 | t5478 = 0.240e2_dp*t1616*t973*t645*t1425 - | ^ -Warning: 't1425' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:42: + 789 | t136 = t32*t114 + | ^ +Warning: 't32' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:18: - 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & - | ^ -note: 't1425' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2379:51: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't32' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - 2379 | t5468 = 0.2346666666e3_dp*t605*t1420 + 1062 | t133*t10 + 0.2e1_dp*t307*t105 | ^ -Warning: 't1420' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:35: +Warning: 't319' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:672:13: - 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & - | ^ -note: 't1420' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: + 672 | t319, t32, t324, t325, t332, t333, t334, t337, t339, t342, t343, t346, t349, t350, t351, & + | ^ +note: 't319' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - 2098 | t3869 + t4657 + t4696) - | ^ -Warning: 't1411' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:284:14: + 1062 | t133*t10 + 0.2e1_dp*t307*t105 + | ^ +Warning: 't316' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:94: - 284 | t1411, t1413, t1417, t1420, t1425, t1426, t1429, t1436, t1438, t1439, t144, t1440, t1443, & - | ^ -note: 't1411' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2644:58: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't316' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - 2644 | t6155 = 0.2500000000e0_dp*t1981*t4032*t1410 - | ^ -Warning: 't1410' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:94: + 1062 | t133*t10 + 0.2e1_dp*t307*t105 + | ^ +Warning: 't315' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:88: - 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & - | ^ -note: 't1410' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:713:98: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't315' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - 713 | t46*t541))*sx - | ^ -Warning: 't141' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:87: + 1062 | t133*t10 + 0.2e1_dp*t307*t105 + | ^ +Warning: 't311' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:82: - 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & - | ^ -note: 't141' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2098:96: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't311' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - 2098 | t3869 + t4657 + t4696) - | ^ -Warning: 't1409' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:81: + 1062 | t133*t10 + 0.2e1_dp*t307*t105 + | ^ +Warning: 't310' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:76: - 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & - | ^ -note: 't1409' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:782:70: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't310' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - 782 | *t165*t462*t561 + 0.3333333334e0_dp*t55*t57*t735 - | ^ -Warning: 't140' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:53: + 1062 | t133*t10 + 0.2e1_dp*t307*t105 + | ^ +Warning: 't309' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:70: - 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & - | ^ -note: 't140' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1725:80: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't309' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - 1725 | *t1368*t437*t907 - 0.3125000000e0_dp*t3262*t45*t166*t3264 - | ^ -Warning: 't14' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:47: + 1062 | t133*t10 + 0.2e1_dp*t307*t105 + | ^ +Warning: 't307' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:64: - 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & - | ^ -note: 't14' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2441:57: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't307' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - 2441 | t5622 = 0.1666666667e0_dp*t165*t1392*t4729 - | ^ -Warning: 't1392' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:28: + 1062 | t133*t10 + 0.2e1_dp*t307*t105 + | ^ +Warning: 't306' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:58: - 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & - | ^ -note: 't1392' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2042:44: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't306' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1051:39: - 2042 | + (2*t147*t1284*t672) - | ^ -Warning: 't1388' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:21: + 1051 | *t531 - t130*t549 + | ^ +Warning: 't302' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:52: - 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & - | ^ -note: 't1388' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't302' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:831:32: - 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 - | ^ -Warning: 't1387' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:283:14: + 831 | t206 = -t3 - t146 + | ^ +Warning: 't3' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:46: - 283 | t1387, t1388, t1392, t1396, t1397, t14, t140, t1401, t1406, t1408, t1409, t141, t1410, & - | ^ -note: 't1387' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't3' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 2034 | *t1246*t3244*t1483 - | ^ -Warning: 't1377' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:95: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't299' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:42: - 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & - | ^ -note: 't1377' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2366:39: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't299' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 2366 | t5432 = t1373*t446*t5430 - | ^ -Warning: 't1373' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:88: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't296' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:36: - 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & - | ^ -note: 't1373' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2259:34: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't296' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1043:31: - 2259 | *t105*t5118 - | ^ -Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:74: + 1043 | t693 = t295*t508 + | ^ +Warning: 't295' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:30: - 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & - | ^ -note: 't137' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1783:38: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't295' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1051:39: - 1783 | t165*t171*t3449 - | ^ -Warning: 't1368' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:68: + 1051 | *t531 - t130*t549 + | ^ +Warning: 't292' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:24: - 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & - | ^ -note: 't1368' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2051:58: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't292' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1051:39: - 2051 | + 0.3333333334e0_dp*t165*t437*t1688 - | ^ -Warning: 't1360' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:54: + 1051 | *t531 - t130*t549 + | ^ +Warning: 't291' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:671:18: - 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & - | ^ -note: 't1360' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:606:31: + 671 | t29, t291, t292, t295, t296, t299, t3, t302, t306, t307, t309, t310, t311, t315, t316, & + | ^ +note: 't291' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1034:31: - 606 | t328 = t136*t233 + 1034 | t589 = t509*t286 | ^ -Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:47: - - 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & - | ^ -note: 't136' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2026:66: +Warning: 't286' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:90: - 2026 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 - | ^ -Warning: 't1348' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:41: + 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & + | ^ +note: 't286' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1038:41: - 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & + 1038 | t603 = t500/t284/t119*t601 | ^ -note: 't1348' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1910:40: - - 1910 | *t400*t1333*t1410 - | ^ -Warning: 't1340' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:27: - - 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & - | ^ -note: 't1340' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2448:57: +Warning: 't284' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:84: - 2448 | t5641 = 0.1500000000e1_dp*t405*t1333*t4729 - | ^ -Warning: 't1333' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:20: + 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & + | ^ +note: 't284' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & - | ^ -note: 't1333' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't283' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:78: - 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 - | ^ -Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:282:13: + 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & + | ^ +note: 't283' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 282 | t133, t1333, t1340, t1347, t1348, t136, t1360, t1367, t1368, t137, t1372, t1373, t1377, & - | ^ -note: 't133' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't282' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:72: - 1923 | t1320*t1483 - | ^ -Warning: 't1320' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:93: + 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & + | ^ +note: 't282' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1035:29: - 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & - | ^ -note: 't1320' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: + 1035 | t595 = t279**2 + | ^ +Warning: 't279' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:60: - 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 - | ^ -Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:86: + 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & + | ^ +note: 't279' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & - | ^ -note: 't132' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1923:34: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't273' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:48: - 1923 | t1320*t1483 - | ^ -Warning: 't1316' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:80: + 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & + | ^ +note: 't273' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:785:29: - 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & - | ^ -note: 't1316' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1536:43: + 785 | t130 = t27*t96 + | ^ +Warning: 't27' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:36: - 1536 | t2565 = t126/t131/t1056/t130 - | ^ -Warning: 't131' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:73: + 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & + | ^ +note: 't27' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & - | ^ -note: 't131' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2459:57: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't269' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:31: - 2459 | t5670 = 0.2250000000e1_dp*t400*t1309*t4729 - | ^ -Warning: 't1309' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:67: + 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & + | ^ +note: 't269' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & - | ^ -note: 't1309' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2463:57: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't268' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:25: - 2463 | t5679 = 0.1875000000e1_dp*t1302*t406*t5002 - | ^ -Warning: 't1302' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:60: + 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & + | ^ +note: 't268' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & - | ^ -note: 't1302' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1900:33: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't261' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:670:13: - 1900 | t3939 = t1301*t245 - | ^ -Warning: 't1301' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:53: + 670 | t261, t267, t268, t269, t27, t270, t273, t276, t279, t281, t282, t283, t284, t286, t287, & + | ^ +note: 't261' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & - | ^ -note: 't1301' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2716:54: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't260' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:97: - 2716 | + 0.4500000000e1_dp*t2009*t4744 - | ^ -Warning: 't1300' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:46: + 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & + | ^ +note: 't260' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1041:39: - 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & - | ^ -note: 't1300' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1536:43: + 1041 | t665 = t26**(-0.40e1_dp) + | ^ +Warning: 't26' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:91: - 1536 | t2565 = t126/t131/t1056/t130 - | ^ -Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:39: + 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & + | ^ +note: 't26' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & - | ^ -note: 't130' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:808:44: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't259' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:86: - 808 | t796 = 0.1e1_dp/t787/t13*t795 - | ^ -Warning: 't13' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:33: + 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & + | ^ +note: 't259' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & - | ^ -note: 't13' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2364:57: + 1144 | *t389*t573*t748 + | ^ +Warning: 't258' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:80: - 2364 | t5429 = 0.1666666667e0_dp*t445*t1292*t5143 - | ^ -Warning: 't1292' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:28: + 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & + | ^ +note: 't258' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & - | ^ -note: 't1292' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2042:44: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't255' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:74: - 2042 | + (2*t147*t1284*t672) - | ^ -Warning: 't1284' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:281:14: + 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & + | ^ +note: 't255' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 281 | t1284, t1288, t1292, t13, t130, t1300, t1301, t1302, t1309, t131, t1316, t132, t1320, & - | ^ -note: 't1284' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2019:39: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't254' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:68: - 2019 | *t429*t1928*t290 - | ^ -Warning: 't1283' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:96: + 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & + | ^ +note: 't254' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & - | ^ -note: 't1283' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2061:71: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't251' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:62: - 2061 | *t3507 - t3512)*t149*t160 - | ^ -Warning: 't1275' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:89: + 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & + | ^ +note: 't251' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1026:62: - 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & - | ^ -note: 't1275' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2026:66: + 1026 | *t246*t509 - 0.9531842928e0_dp*t102*t522 + | ^ +Warning: 't246' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:51: - 2026 | *t1410 - 0.1666666667e0_dp*t429*t1392*t1410 - | ^ -Warning: 't1264' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:75: + 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & + | ^ +note: 't246' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1114:39: - 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & - | ^ -note: 't1264' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: + 1114 | *t841 - t187*t851 + | ^ +Warning: 't245' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:45: - 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 - | ^ -Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:68: + 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & + | ^ +note: 't245' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & - | ^ -note: 't126' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2497:59: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't241' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:669:27: - 2497 | t5776 = 0.2777777778e-1_dp*t1246*t1247*t5009 - | ^ -Warning: 't1247' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:55: + 669 | REAL(KIND=dp) :: t241, t242, t244, t245, t246, t25, t251, t254, t255, t258, t259, t26, t260, & + | ^ +note: 't241' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1022:49: - 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & - | ^ -note: 't1247' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2497:59: + 1022 | t538 = 0.1211413728e1_dp*t240*t508 + | ^ +Warning: 't240' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:72: - 2497 | t5776 = 0.2777777778e-1_dp*t1246*t1247*t5009 - | ^ -Warning: 't1246' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:48: + 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 + | ^ +note: 't240' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:908:60: - 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & - | ^ -note: 't1246' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: + 908 | *t325*t287)*t38) + | ^ +Warning: 't24' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:66: - 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 + 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 | ^ -Warning: 't1235' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:27: +note: 't24' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1013:30: - 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & - | ^ -note: 't1235' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1667:76: + 1013 | t513 = t92*t237 + | ^ +Warning: 't237' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:61: - 1667 | t1143*t183*t2779 + 0.1200000000e2_dp*t473*t1157*t2368 - | ^ -Warning: 't123' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:20: + 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 + | ^ +note: 't237' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & - | ^ -note: 't123' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't236' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:55: - 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 - | ^ -Warning: 't1224' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:280:14: + 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 + | ^ +note: 't236' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 280 | t1224, t123, t1235, t1238, t1239, t1246, t1247, t1254, t126, t1264, t1268, t1275, t1283, & - | ^ -note: 't1224' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't235' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:49: - 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 - | ^ -Warning: 't1221' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:95: + 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 + | ^ +note: 't235' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1100:31: - 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & - | ^ -note: 't1221' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:619:81: + 1100 | t820 = t231*t165 + | ^ +Warning: 't231' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:43: - 619 | t360 = 0.28e2_dp/0.3e1_dp*t122*t114 - 0.28e2_dp/0.3e1_dp*t356*t357 - | ^ -Warning: 't122' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:88: + 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 + | ^ +note: 't231' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: - 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & - | ^ -note: 't122' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: + 1176 | + t489)*sc + | ^ +Warning: 't230' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:37: - 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 - | ^ -Warning: 't1216' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:82: + 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 + | ^ +note: 't230' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & - | ^ -note: 't1216' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't226' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:31: - 1983 | t192*t68*t4256*t65 - | ^ -Warning: 't1213' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:75: + 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 + | ^ +note: 't226' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & - | ^ -note: 't1213' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: + 1078 | *bp*t625*t565*t559 + | ^ +Warning: 't225' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:25: - 1954 | *t58*t3796*t71 - | ^ -Warning: 't1207' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:61: + 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 + | ^ +note: 't225' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1096:31: - 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & - | ^ -note: 't1207' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: + 1096 | t807 = t222*t165 + | ^ +Warning: 't222' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:668:13: - 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 - | ^ -Warning: 't1201' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:47: + 668 | t222, t223, t225, t226, t230, t231, t235, t236, t237, t24, t240 + | ^ +note: 't222' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1176:50: - 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & - | ^ -note: 't1201' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: + 1176 | + t489)*sc + | ^ +Warning: 't221' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:94: - 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 - | ^ -Warning: 't1200' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:40: + 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + | ^ +note: 't221' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1005:39: - 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & - | ^ -note: 't1200' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1803:35: + 1005 | t499 = 0.1e1_dp/t220/t90 + | ^ +Warning: 't220' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:88: - 1803 | t3546 = 0.1e1_dp/t12 - | ^ -Warning: 't12' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:33: + 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + | ^ +note: 't220' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1012:31: - 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & - | ^ -note: 't12' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: + 1012 | t510 = t217*t509 + | ^ +Warning: 't217' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:70: - 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 - | ^ -Warning: 't1194' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:279:28: + 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + | ^ +note: 't217' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1009:35: - 279 | REAL(KIND=dp) :: t1194, t12, t1200, t1201, t1206, t1207, t1210, t1213, t1216, t122, t1221, & - | ^ -note: 't1194' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1940:66: + 1009 | t505 = t216*t96*t504 + | ^ +Warning: 't216' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:64: - 1940 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 - | ^ -Warning: 't1193' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:69: + 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + | ^ +note: 't216' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:999:102: - 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 - | ^ -note: 't1193' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: + 999 | e_bb(ip) = e_bb(ip) + ((t332 + t489 + t490 + t452)*t2 + t455 + 0.2e1_dp*t213 + t457)*sc + | ^ +Warning: 't213' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:58: - 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 - | ^ -Warning: 't1192' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:62: + 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + | ^ +note: 't213' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1157:31: - 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 - | ^ -note: 't1192' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: + 1157 | t986 = t212*t451 + | ^ +Warning: 't212' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:52: - 1841 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:48: + 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + | ^ +note: 't212' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 - | ^ -note: 't119' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2010:66: + 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc + | ^ +Warning: 't209' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:41: - 2010 | *t722*t1722 - 0.5555555558e-1_dp*t719*t1235 - | ^ -Warning: 't1189' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:42: + 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + | ^ +note: 't209' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1184:101: - 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 - | ^ -note: 't1189' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1975:29: + 1184 | + t950)*t2 + t953 + 0.3e1_dp*t489 + 0.6e1_dp*t472 + t956)*sc + | ^ +Warning: 't206' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:35: - 1975 | *t3382 - | ^ -Warning: 't1176' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:35: + 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + | ^ +note: 't206' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:975:35: - 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 + 975 | t457 = 0.2e1_dp*t203 | ^ -note: 't1176' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: +Warning: 't203' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:29: - 2034 | *t1246*t3244*t1483 - | ^ -Warning: 't1172' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:28: + 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + | ^ +note: 't203' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1156:40: - 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 - | ^ -note: 't1172' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: + 1156 | t984 = 0.2e1_dp*t470*t202 + | ^ +Warning: 't202' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:23: - 2034 | *t1246*t3244*t1483 - | ^ -Warning: 't1168' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:21: + 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + | ^ +note: 't202' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:836:75: - 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 - | ^ -note: 't1168' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1965:39: + 836 | e_b(ip) = e_b(ip) + ((t144 + t213 + t203)*t2 + t42 + t86)*sc + | ^ +Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:17: - 1965 | *t478*t183*t3918 - | ^ -Warning: 't1161' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:278:14: + 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + | ^ +note: 't2' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 278 | t1161, t1168, t1172, t1176, t1189, t119, t1191, t1192, t1193 - | ^ -note: 't1161' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't194' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:667:13: - 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 - | ^ -Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:95: + 667 | t194, t2, t202, t203, t206, t209, t21, t212, t213, t216, t217, t218, t219, t220, t221, & + | ^ +note: 't194' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:963:31: - 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't116' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1975:29: + 963 | t437 = t193*t245 + | ^ +Warning: 't193' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:96: - 1975 | *t3382 - | ^ -Warning: 't1157' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:89: + 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & + | ^ +note: 't193' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1128:51: - 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1157' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2528:57: + 1128 | - 0.1588640487e1_dp*t437*t860 + | ^ +Warning: 't191' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:90: - 2528 | t5864 = 0.1800000000e2_dp*t473*t1150*t4729 - | ^ -Warning: 't1150' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:82: + 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & + | ^ +note: 't191' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:957:31: - 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1150' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1187:50: + 957 | t425 = t424*t190 + | ^ +Warning: 't190' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:84: - 1187 | t1636 = 0.5600000000e2_dp*t624*t115 - | ^ -Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:75: + 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & + | ^ +note: 't190' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:959:31: - 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't115' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2505:57: + 959 | t428 = t189*t427 + | ^ +Warning: 't189' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:73: - 2505 | t5801 = 0.3600000000e2_dp*t1143*t479*t5002 - | ^ -Warning: 't1143' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:69: + 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & + | ^ +note: 't189' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:956:43: - 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1143' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1966:33: + 956 | t420*t365 - t187*t373 + | ^ +Warning: 't187' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:67: - 1966 | t4230 = t1142*t262 - | ^ -Warning: 't1142' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:62: + 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & + | ^ +note: 't187' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1114:39: - 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1142' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2613:63: + 1114 | *t841 - t187*t851 + | ^ +Warning: 't184' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:61: - 2613 | t6074 = 0.8099999996e2_dp*t496*t4769*t1141*t4915 - | ^ -Warning: 't1141' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:55: + 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & + | ^ +note: 't184' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:943:31: - 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1141' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:619:81: + 943 | t397 = t231*t179 + | ^ +Warning: 't179' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:43: - 619 | t360 = 0.28e2_dp/0.3e1_dp*t122*t114 - 0.28e2_dp/0.3e1_dp*t356*t357 - | ^ -Warning: 't114' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:41: + 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & + | ^ +note: 't179' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1094:41: - 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & + 1094 | t800 = t500/t405/t178*t798 | ^ -note: 't114' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: - - 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 - | ^ -Warning: 't1137' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:35: +Warning: 't178' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:37: - 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1137' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: + 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & + | ^ +note: 't178' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1093:29: - 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 - | ^ -Warning: 't1134' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:28: + 1093 | t798 = t176**2 + | ^ +Warning: 't176' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:31: - 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1134' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: + 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & + | ^ +note: 't176' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 - | ^ -Warning: 't1129' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:21: + 1144 | *t389*t573*t748 + | ^ +Warning: 't175' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:25: - 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1129' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: + 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & + | ^ +note: 't175' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:942:31: - 1954 | *t58*t3796*t71 - | ^ -Warning: 't1126' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:277:14: + 942 | t394 = t174*t245 + | ^ +Warning: 't174' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:666:19: - 277 | t1126, t1129, t1134, t1137, t114, t1140, t1141, t1142, t1143, t115, t1150, t1157, t116, & - | ^ -note: 't1126' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: + 666 | t173, t174, t175, t176, t178, t179, t180, t183, t184, t187, t189, t19, t190, t191, t193, & + | ^ +note: 't174' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1117:40: - 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 - | ^ -Warning: 't1125' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:95: + 1117 | t872 = 0.1e1_dp/t400/t172 + | ^ +Warning: 't172' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:95: - 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & | ^ -note: 't1125' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1990:66: +note: 't172' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 1990 | *t719*t1122 + 0.7407407410e-1_dp*t508*t1726 - | ^ -Warning: 't1122' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:88: + 1144 | *t389*t573*t748 + | ^ +Warning: 't169' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:89: - 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1122' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2419:33: + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & + | ^ +note: 't169' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:935:31: - 2419 | t5565 = t112*t1685 - | ^ -Warning: 't112' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:81: + 935 | t380 = t168*t258 + | ^ +Warning: 't168' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:83: - 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't112' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1996:67: + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & + | ^ +note: 't168' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:972:67: - 1996 | *t1774*t1712 + 0.7407407410e-1_dp*t719*t1119 + 972 | *t443*t408)*t80) - t332 | ^ -Warning: 't1119' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:75: +Warning: 't165' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:77: - 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1119' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1954:37: + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & + | ^ +note: 't165' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1107:62: - 1954 | *t58*t3796*t71 + 1107 | *t368*t509 - 0.9531842928e0_dp*t162*t522 + | ^ +Warning: 't162' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:71: + + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & + | ^ +note: 't162' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: + + 1144 | *t389*t573*t748 | ^ -Warning: 't1111' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:68: +Warning: 't161' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:65: - 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1111' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2002:64: + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & + | ^ +note: 't161' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:923:30: - 2002 | + 0.7407407410e-1_dp*t192*t194*t1836*t526 - | ^ -Warning: 't1109' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:61: + 923 | t356 = t88*t160 + | ^ +Warning: 't160' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:59: - 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1109' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1940:66: + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & + | ^ +note: 't160' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:878:39: - 1940 | *t1722 + 0.3703703706e0_dp*t1193*t1505*t451 - | ^ -Warning: 't1106' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:54: + 878 | t281 = 0.1e1_dp/t279/t16 + | ^ +Warning: 't16' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:53: - 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1106' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & + | ^ +note: 't16' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1102:29: - 1983 | t192*t68*t4256*t65 - | ^ -Warning: 't1101' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:47: + 1102 | t835 = t159**2 + | ^ +Warning: 't159' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:48: - 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1101' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & + | ^ +note: 't159' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1144:37: - 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 - | ^ -Warning: 't1100' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:40: + 1144 | *t389*t573*t748 + | ^ +Warning: 't156' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:42: - 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1100' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:608:30: + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & + | ^ +note: 't156' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:989:48: - 608 | t332 = t11*t114 - | ^ -Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:33: + 989 | + t213)*sc + | ^ +Warning: 't155' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:36: - 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't11' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1983:41: + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & + | ^ +note: 't155' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1085:31: - 1983 | t192*t68*t4256*t65 - | ^ -Warning: 't1097' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:21: + 1085 | t745 = t154*t451 + | ^ +Warning: 't154' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:30: - 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1097' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2070:60: + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & + | ^ +note: 't154' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:981:31: - 2070 | + 0.2500000000e0_dp*t1981*t2707*t1410 - | ^ -Warning: 't1093' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:276:14: + 981 | t464 = t342*t151 + | ^ +Warning: 't151' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:24: - 276 | t1093, t1097, t1099, t11, t1100, t1101, t1106, t1109, t1111, t1119, t112, t1122, t1125, & - | ^ -note: 't1093' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2034:41: + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & + | ^ +note: 't151' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:982:30: - 2034 | *t1246*t3244*t1483 - | ^ -Warning: 't1085' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:89: + 982 | t467 = t150*t43 + | ^ +Warning: 't150' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:665:18: - 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't1085' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:740:45: + 665 | t15, t150, t151, t154, t155, t156, t159, t16, t160, t161, t162, t165, t168, t169, t172, & + | ^ +note: 't150' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:979:31: - 740 | t635 = -4*t108 + 4*t332*my_rho - | ^ -Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:75: + 979 | t458 = t333*t147 + | ^ +Warning: 't147' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:96: - 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't108' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2318:57: + 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & + | ^ +note: 't147' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:980:30: - 2318 | t5311 = 0.1666666668e0_dp*t289*t1071*t4701 - | ^ -Warning: 't1071' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:55: + 980 | t461 = t145*t43 + | ^ +Warning: 't145' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:84: - 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't1071' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:745:73: + 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & + | ^ +note: 't145' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:974:35: - 745 | + 0.60e1_dp*t119*t637 - 0.60e1_dp*t7*t640*t126*t371 - | ^ -Warning: 't107' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:48: + 974 | t455 = 0.2e1_dp*t144 + | ^ +Warning: 't144' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:78: - 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't107' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2053:33: + 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & + | ^ +note: 't144' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - 2053 | t4575 = t1067*t561 - | ^ -Warning: 't1067' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:35: + 1062 | t133*t10 + 0.2e1_dp*t307*t105 + | ^ +Warning: 't137' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:67: - 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't1067' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: + 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & + | ^ +note: 't137' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:899:31: - 1831 | *t3339 - | ^ -Warning: 't1064' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:28: + 899 | t319 = t136*t245 + | ^ +Warning: 't136' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:61: - 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't1064' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1857:39: + 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & + | ^ +note: 't136' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1062:51: - 1857 | *t321*t953*t1625 - | ^ -Warning: 't1063' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:21: + 1062 | t133*t10 + 0.2e1_dp*t307*t105 + | ^ +Warning: 't134' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:55: - 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't1063' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2725:40: + 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & + | ^ +note: 't134' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:893:31: - 2725 | *t1054*t640*t3679 - | ^ -Warning: 't1060' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:275:14: + 893 | t307 = t306*t133 + | ^ +Warning: 't133' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:49: - 275 | t1060, t1063, t1064, t1067, t1068, t107, t1071, t1076, t1079, t108, t1082, t1085, t1089, & - | ^ -note: 't1060' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1461:31: + 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & + | ^ +note: 't133' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:895:31: - 1461 | t2204 = t10*t106 + 895 | t310 = t132*t309 | ^ -Warning: 't106' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:95: +Warning: 't132' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:43: - 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't106' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2155:59: + 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & + | ^ +note: 't132' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:892:43: - 2155 | - 0.2400000000e2_dp*t786/t2492*t1058 - | ^ -Warning: 't1058' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:82: + 892 | t302*t237 - t130*t251 + | ^ +Warning: 't130' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:37: - 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't1058' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2400:67: + 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & + | ^ +note: 't130' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:972:67: - 2400 | *t5511 + 0.1200000000e3_dp*t1055*t2565*t4721 + 972 | *t443*t408)*t80) - t332 | ^ -Warning: 't1055' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:68: +Warning: 't127' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:31: - 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't1055' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2725:40: + 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & + | ^ +note: 't127' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:888:31: - 2725 | *t1054*t640*t3679 - | ^ -Warning: 't1054' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:61: + 888 | t299 = t126*t230 + | ^ +Warning: 't126' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:25: - 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't1054' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: + 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & + | ^ +note: 't126' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1051:39: - 1850 | *t786*t1034*t1681 - | ^ -Warning: 't1050' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:54: + 1051 | *t531 - t130*t549 + | ^ +Warning: 't125' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:664:19: - 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't1050' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:565:31: + 664 | t124, t125, t126, t127, t130, t132, t133, t134, t136, t137, t14, t144, t145, t146, t147, & + | ^ +note: 't125' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:876:31: - 565 | t234 = t105*t233 + 876 | t276 = t231*t120 | ^ -Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:47: - - 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't105' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: +Warning: 't120' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:91: - 1841 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't1046' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:41: + 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & + | ^ +note: 't120' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1038:41: - 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & + 1038 | t603 = t500/t284/t119*t601 | ^ -note: 't1046' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: - - 1841 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't1044' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:34: - - 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't1044' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:599:30: - - 599 | t316 = t97*t104 - | ^ -Warning: 't104' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:20: - - 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't104' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: - - 1850 | *t786*t1034*t1681 - | ^ -Warning: 't1036' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:274:14: +Warning: 't119' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:85: - 274 | t1036, t104, t1040, t1044, t1046, t105, t1050, t1054, t1055, t1056, t1058, t1059, t106, & - | ^ -note: 't1036' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: + 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & + | ^ +note: 't119' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1037:29: - 1850 | *t786*t1034*t1681 - | ^ -Warning: 't1034' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:96: + 1037 | t601 = t117**2 + | ^ +Warning: 't117' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:79: - 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1034' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: + 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & + | ^ +note: 't117' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 1850 | *t786*t1034*t1681 + 1078 | *bp*t625*t565*t559 | ^ -Warning: 't1030' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:82: +Warning: 't116' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:73: - 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1030' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:876:29: + 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & + | ^ +note: 't116' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:875:31: - 876 | t972 = t103**2 - | ^ -Warning: 't103' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:75: + 875 | t273 = t115*t245 + | ^ +Warning: 't115' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:67: - 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't103' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: + 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & + | ^ +note: 't115' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1028:40: - 1850 | *t786*t1034*t1681 + 1028 | t563 = 0.1e1_dp/t279/t113 | ^ -Warning: 't1026' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:69: +Warning: 't113' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:55: - 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1026' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: + 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & + | ^ +note: 't113' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1078:40: - 1850 | *t786*t1034*t1681 + 1078 | *bp*t625*t565*t559 | ^ -Warning: 't1024' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:62: - - 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1024' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: +Warning: 't110' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:49: - 1850 | *t786*t1034*t1681 - | ^ -Warning: 't1021' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:55: + 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & + | ^ +note: 't110' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:758:28: - 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1021' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:2403:43: + 758 | t89 = t88*t11 + | ^ +Warning: 't11' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:43: - 2403 | t5528 = t102*t327*t1684*t557 + 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & | ^ -Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:48: - - 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't102' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1764:32: +note: 't11' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:866:31: - 1764 | t12*t1058 - | ^ -Warning: 't1014' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:35: + 866 | t255 = t254*t109 + | ^ +Warning: 't109' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:38: - 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1014' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: + 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & + | ^ +note: 't109' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:868:31: - 1850 | *t786*t1034*t1681 - | ^ -Warning: 't1012' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:28: + 868 | t259 = t108*t258 + | ^ +Warning: 't108' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:32: - 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1012' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1850:40: + 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & + | ^ +note: 't108' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:908:60: - 1850 | *t786*t1034*t1681 - | ^ -Warning: 't1008' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:21: + 908 | *t325*t287)*t38) + | ^ +Warning: 't105' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:26: - 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1008' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1841:54: + 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & + | ^ +note: 't105' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:1026:62: - 1841 | + 0.3200000000e2_dp*t1055*t3674 - | ^ -Warning: 't1004' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:273:14: + 1026 | *t246*t509 - 0.9531842928e0_dp*t102*t522 + | ^ +Warning: 't102' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:663:13: - 273 | t1004, t1008, t1012, t1014, t1019, t102, t1021, t1024, t1026, t103, t1030, t1033, t1034, & - | ^ -note: 't1004' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:1831:29: + 663 | t102, t1031, t105, t108, t109, t11, t110, t113, t114, t115, t116, t117, t119, t120, t121, & + | ^ +note: 't102' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:885:31: - 1831 | *t3339 - | ^ -Warning: 't1000' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:272:90: + 885 | t292 = t291*t101 + | ^ +Warning: 't101' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:662:85: - 272 | REAL(KIND=dp) :: Cx, epsilon_rho43, my_epsilon_rho, my_ndrho, my_rho, t1, t10, t1000, t1002, & - | ^ -note: 't1000' was declared here -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:895:50: + 662 | REAL(KIND=dp) :: ap, bp, cp, myrho, myrhoa, myrhob, Qf, Qp, t1, t10, t100, t101, t1019, & + | ^ +note: 't101' was declared here +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:792:82: - 895 | t1019 = 0.1e1_dp/t19/t1014*t787*t10 - | ^ + 792 | t121 - t24*(t134*t10 + 0.3177280975e0_dp*t137*t121)*t38) + | ^ Warning: 't10' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F:272:83: +/build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F:662:73: - 272 | REAL(KIND=dp) :: Cx, epsilon_rho43, my_epsilon_rho, my_ndrho, my_rho, t1, t10, t1000, t1002, & - | ^ + 662 | REAL(KIND=dp) :: ap, bp, cp, myrho, myrhoa, myrhob, Qf, Qp, t1, t10, t100, t101, t1019, & + | ^ note: 't10' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xbecke88_lr_adiabatic.mod' due to: xc_xbecke88_lr_adiabatic.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xbecke88_lr_adiabatic.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod mathconstants.mod base_hooks.mod bibliography.mod cp_array_utils.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_exchange_gga.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_exchange_gga.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod cp_log_handling.mod mathconstants.mod xc_input_constants.mod base_hooks.mod cp_array_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_exchange_gga.F xc_exchange_gga.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:09:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_exchange_gga.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_exchange_gga.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_exchange_gga.mod' due to: xc_exchange_gga.o /build/reproducible-path/cp2k-8.1/src/xc/xc_exchange_gga.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod xc_functionals_utilities.mod cp_log_handling.mod mathconstants.mod xc_input_constants.mod base_hooks.mod cp_array_utils.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_vwn.mod' due to: xc_vwn.o /build/reproducible-path/cp2k-8.1/src/xc/xc_vwn.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod kinds.mod xc_functionals_utilities.mod xc_input_constants.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_perdew86.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew86.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod xc_input_constants.mod xc_perdew_zunger.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew86.F xc_perdew86.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:10:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_perdew86.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_perdew86.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_perdew86.mod' due to: xc_perdew86.o /build/reproducible-path/cp2k-8.1/src/xc/xc_perdew86.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_derivative_types.mod xc_functionals_utilities.mod base_hooks.mod xc_input_constants.mod xc_perdew_zunger.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_xbr_pbe_lda_hole_t_c_lr.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_xbr_pbe_lda_hole_t_c_lr.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod xc_xbecke_roussel.mod xc_xlda_hole_t_c_lr.mod xc_xpbe_hole_t_c_lr.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_xbr_pbe_lda_hole_t_c_lr.F xc_xbr_pbe_lda_hole_t_c_lr.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:22:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_xbr_pbe_lda_hole_t_c_lr.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_xbr_pbe_lda_hole_t_c_lr.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_xbr_pbe_lda_hole_t_c_lr.mod' due to: xc_xbr_pbe_lda_hole_t_c_lr.o /build/reproducible-path/cp2k-8.1/src/xc/xc_xbr_pbe_lda_hole_t_c_lr.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod kinds.mod xc_xbecke_roussel.mod xc_xlda_hole_t_c_lr.mod xc_xpbe_hole_t_c_lr.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_derivatives.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_derivatives.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_xbecke_roussel.mod xc_xbecke88.mod xc_b97.mod xc_vwn.mod kinds.mod xc_tfw.mod xc_perdew_wang.mod xc_thomas_fermi.mod xc_ke_gga.mod xc_xbecke88_long_range.mod xc_hcth.mod xc_tpss.mod xc_lyp_adiabatic.mod xc_pade.mod xc_xwpbe.mod xc_xpbe_hole_t_c_lr.mod xc_xbeef.mod xc_libxc.mod xc_xbr_pbe_lda_hole_t_c_lr.mod xc_lyp.mod xc_pbe.mod xc_sr_lda.mod xc_xalpha.mod xc_xlda_hole_t_c_lr.mod base_hooks.mod xc_cs1.mod xc_optx.mod xc_perdew_zunger.mod xc_xbecke88_lr_adiabatic.mod xc_exchange_gga.mod xc_perdew86.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_derivatives.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_derivatives.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod input_section_types.mod xc_pbe.mod kinds.mod xc_perdew_wang.mod xc_xpbe_hole_t_c_lr.mod xc_xbeef.mod xc_xbecke88_long_range.mod xc_cs1.mod xc_xwpbe.mod xc_xbecke88.mod xc_hcth.mod xc_tpss.mod xc_xbecke88_lr_adiabatic.mod xc_lyp.mod xc_thomas_fermi.mod xc_b97.mod xc_exchange_gga.mod xc_perdew_zunger.mod xc_xalpha.mod xc_xlda_hole_t_c_lr.mod xc_pade.mod xc_optx.mod xc_tfw.mod xc_lyp_adiabatic.mod base_hooks.mod xc_perdew86.mod xc_xbecke_roussel.mod xc_libxc.mod xc_ke_gga.mod xc_sr_lda.mod xc_vwn.mod xc_xbr_pbe_lda_hole_t_c_lr.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_derivatives.F xc_derivatives.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:10:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_derivatives.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_derivatives.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_derivatives.mod' due to: xc_derivatives.o /build/reproducible-path/cp2k-8.1/src/xc/xc_derivatives.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod xc_xbecke_roussel.mod xc_xbecke88.mod xc_b97.mod xc_vwn.mod kinds.mod xc_tfw.mod xc_perdew_wang.mod xc_thomas_fermi.mod xc_ke_gga.mod xc_xbecke88_long_range.mod xc_hcth.mod xc_tpss.mod xc_lyp_adiabatic.mod xc_pade.mod xc_xwpbe.mod xc_xpbe_hole_t_c_lr.mod xc_xbeef.mod xc_libxc.mod xc_xbr_pbe_lda_hole_t_c_lr.mod xc_lyp.mod xc_pbe.mod xc_sr_lda.mod xc_xalpha.mod xc_xlda_hole_t_c_lr.mod base_hooks.mod xc_cs1.mod xc_optx.mod xc_perdew_zunger.mod xc_xbecke88_lr_adiabatic.mod xc_exchange_gga.mod xc_perdew86.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_output.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_output.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod input_constants.mod periodic_table.mod base_hooks.mod mathconstants.mod xc_derivatives.mod atom_utils.mod input_cp2k_check.mod xc_libxc.mod cp_files.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_output.F atom_output.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:10:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_output.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_output.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_output.mod' due to: atom_output.o /build/reproducible-path/cp2k-8.1/src/atom_output.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod input_constants.mod periodic_table.mod base_hooks.mod mathconstants.mod xc_derivatives.mod atom_utils.mod input_cp2k_check.mod xc_libxc.mod cp_files.mod physcon.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:23:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_derivatives.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_derivatives.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_derivatives.mod' due to: xc_derivatives.o /build/reproducible-path/cp2k-8.1/src/xc/xc_derivatives.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_cflags_types.mod xc_derivative_set_types.mod xc_rho_set_types.mod input_section_types.mod xc_pbe.mod kinds.mod xc_perdew_wang.mod xc_xpbe_hole_t_c_lr.mod xc_xbeef.mod xc_xbecke88_long_range.mod xc_cs1.mod xc_xwpbe.mod xc_xbecke88.mod xc_hcth.mod xc_tpss.mod xc_xbecke88_lr_adiabatic.mod xc_lyp.mod xc_thomas_fermi.mod xc_b97.mod xc_exchange_gga.mod xc_perdew_zunger.mod xc_xalpha.mod xc_xlda_hole_t_c_lr.mod xc_pade.mod xc_optx.mod xc_tfw.mod xc_lyp_adiabatic.mod base_hooks.mod xc_perdew86.mod xc_xbecke_roussel.mod xc_libxc.mod xc_ke_gga.mod xc_sr_lda.mod xc_vwn.mod xc_xbr_pbe_lda_hole_t_c_lr.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_optimization.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_optimization.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod lapack.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_optimization.F atom_optimization.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:10:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_optimization.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_optimization.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_optimization.mod' due to: atom_optimization.o /build/reproducible-path/cp2k-8.1/src/atom_optimization.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod lapack.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod pw_types.mod xc_rho_set_types.mod pw_pool_types.mod xc_derivative_types.mod input_section_types.mod pw_grid_types.mod pw_methods.mod cp_linked_list_xc_deriv.mod kinds.mod kahan_sum.mod xc_input_constants.mod cp_array_utils.mod message_passing.mod xc_derivatives.mod xc_derivative_desc.mod cp_log_handling.mod base_hooks.mod pw_spline_utils.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod xc_derivative_set_types.mod pw_grid_types.mod pw_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod cp_log_handling.mod kinds.mod cp_linked_list_xc_deriv.mod message_passing.mod kahan_sum.mod xc_derivative_desc.mod xc_input_constants.mod cp_array_utils.mod pw_methods.mod xc_derivatives.mod base_hooks.mod pw_spline_utils.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc.F xc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:10:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:23:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc.F90 /build/reproducible-path/cp2k-8.1/src/xc/xc.F:1558:22: 1558 | IF (dealloc_pw_to_deriv) THEN | ^ Warning: 'dealloc_pw_to_deriv' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc.mod' due to: xc.o /build/reproducible-path/cp2k-8.1/src/xc/xc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod pw_types.mod xc_rho_set_types.mod pw_pool_types.mod xc_derivative_types.mod input_section_types.mod pw_grid_types.mod pw_methods.mod cp_linked_list_xc_deriv.mod kinds.mod kahan_sum.mod xc_input_constants.mod cp_array_utils.mod message_passing.mod xc_derivatives.mod xc_derivative_desc.mod cp_log_handling.mod base_hooks.mod pw_spline_utils.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc.mod' due to: xc.o /build/reproducible-path/cp2k-8.1/src/xc/xc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod xc_derivative_set_types.mod pw_grid_types.mod pw_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod cp_log_handling.mod kinds.mod cp_linked_list_xc_deriv.mod message_passing.mod kahan_sum.mod xc_derivative_desc.mod xc_input_constants.mod cp_array_utils.mod pw_methods.mod xc_derivatives.mod base_hooks.mod pw_spline_utils.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod pw_types.mod input_section_types.mod pw_pool_types.mod xc_derivative_types.mod xc_derivatives.mod base_hooks.mod cp_linked_list_xc_deriv.mod xc.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/xc/xc_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod xc_rho_cflags_types.mod pw_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod kinds.mod xc.mod xc_derivatives.mod cp_linked_list_xc_deriv.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc/xc_atom.F xc_atom.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:10:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_atom.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_atom.mod' due to: xc_atom.o /build/reproducible-path/cp2k-8.1/src/xc/xc_atom.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod pw_types.mod input_section_types.mod pw_pool_types.mod xc_derivative_types.mod xc_derivatives.mod base_hooks.mod cp_linked_list_xc_deriv.mod xc.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:23:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc/xc_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/xc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_atom.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_atom.mod' due to: xc_atom.o /build/reproducible-path/cp2k-8.1/src/xc/xc_atom.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod xc_rho_cflags_types.mod pw_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod kinds.mod xc.mod xc_derivatives.mod cp_linked_list_xc_deriv.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_xc.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_xc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod atom_types.mod xc_derivative_types.mod input_constants.mod mathconstants.mod xc_derivatives.mod base_hooks.mod atom_utils.mod cp_files.mod xc_atom.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_xc.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_xc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod cp_files.mod kinds.mod xc_atom.mod atom_utils.mod input_constants.mod xc_derivatives.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_xc.F atom_xc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:10:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_xc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_xc.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_xc.mod' due to: atom_xc.o /build/reproducible-path/cp2k-8.1/src/atom_xc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_rho_set_types.mod xc_derivative_set_types.mod xc_rho_cflags_types.mod input_section_types.mod atom_types.mod xc_derivative_types.mod input_constants.mod mathconstants.mod xc_derivatives.mod base_hooks.mod atom_utils.mod cp_files.mod xc_atom.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:23:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_xc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_xc.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_xc.mod' due to: atom_xc.o /build/reproducible-path/cp2k-8.1/src/atom_xc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod xc_derivative_set_types.mod xc_derivative_types.mod xc_rho_set_types.mod xc_rho_cflags_types.mod input_section_types.mod mathconstants.mod cp_files.mod kinds.mod xc_atom.mod atom_utils.mod input_constants.mod xc_derivatives.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_optimization.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_optimization.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod base_hooks.mod lapack.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_optimization.F atom_optimization.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:24:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_optimization.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_optimization.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_optimization.mod' due to: atom_optimization.o /build/reproducible-path/cp2k-8.1/src/atom_optimization.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod base_hooks.mod lapack.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_check.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_check.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_val_types.mod cp_parser_types.mod input_section_types.mod input_keyword_types.mod input_parsing.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod xc_input_constants.mod memory_utilities.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_check.F input_cp2k_check.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:24:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_check.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_check.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_check.mod' due to: input_cp2k_check.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_check.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_val_types.mod cp_parser_types.mod input_section_types.mod input_keyword_types.mod input_parsing.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod xc_input_constants.mod memory_utilities.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_output.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_output.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod mathconstants.mod input_cp2k_check.mod cp_files.mod kinds.mod atom_utils.mod input_constants.mod physcon.mod xc_derivatives.mod xc_libxc.mod periodic_table.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_output.F atom_output.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:24:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_output.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_output.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_output.mod' due to: atom_output.o /build/reproducible-path/cp2k-8.1/src/atom_output.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod mathconstants.mod input_cp2k_check.mod cp_files.mod kinds.mod atom_utils.mod input_constants.mod physcon.mod xc_derivatives.mod xc_libxc.mod periodic_table.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_electronic_structure.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_electronic_structure.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod input_constants.mod base_hooks.mod atom_optimization.mod atom_xc.mod atom_utils.mod atom_output.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_electronic_structure.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_electronic_structure.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod atom_xc.mod kinds.mod atom_utils.mod atom_optimization.mod input_constants.mod atom_output.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_electronic_structure.F atom_electronic_structure.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:11:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_electronic_structure.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_electronic_structure.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:24:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_electronic_structure.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_electronic_structure.F90 /build/reproducible-path/cp2k-8.1/src/atom_electronic_structure.F:691:13: 691 | IF (need_xc) THEN @@ -41240,33 +41121,11 @@ 137 | need_x, need_xc, need_zmp | ^ note: 'need_x' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_electronic_structure.mod' due to: atom_electronic_structure.o /build/reproducible-path/cp2k-8.1/src/atom_electronic_structure.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod input_constants.mod base_hooks.mod atom_optimization.mod atom_xc.mod atom_utils.mod atom_output.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_fm_diag.mod' due to: cp_fm_diag.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dkh_main.o' due to: /build/reproducible-path/cp2k-8.1/src/dkh_main.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_fm_types.mod base_hooks.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_fm_cholesky.mod cp_blacs_env.mod physcon.mod cp_fm_basic_linalg.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dkh_main.F dkh_main.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:11:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dkh_main.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dkh_main.F90 -/build/reproducible-path/cp2k-8.1/src/dkh_main.F:101:37: - - 101 | SUBROUTINE DKH_full_transformation(qs_env, matrix_s, matrix_v, matrix_t, matrix_pVp, n, dkh_order) - | ^ -Warning: 'dkh_full_transformation' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/dkh_main.F:746:20: - - 746 | SUBROUTINE even4a(n, ev4, e1, pe1p, vv, gg) - | ^ -Warning: 'even4a' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dkh_main.mod' due to: dkh_main.o /build/reproducible-path/cp2k-8.1/src/dkh_main.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_fm_types.mod base_hooks.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_fm_cholesky.mod cp_blacs_env.mod physcon.mod cp_fm_basic_linalg.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_operators.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_operators.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_constants.mod ai_onecenter.mod periodic_table.mod mathlib.mod base_hooks.mod lapack.mod mathconstants.mod atom_utils.mod dkh_main.mod qs_grid_atom.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_operators.F atom_operators.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:12:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_operators.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_operators.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_operators.mod' due to: atom_operators.o /build/reproducible-path/cp2k-8.1/src/atom_operators.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_constants.mod ai_onecenter.mod periodic_table.mod mathlib.mod base_hooks.mod lapack.mod mathconstants.mod atom_utils.mod dkh_main.mod qs_grid_atom.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_electronic_structure.mod' due to: atom_electronic_structure.o /build/reproducible-path/cp2k-8.1/src/atom_electronic_structure.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod atom_xc.mod kinds.mod atom_utils.mod atom_optimization.mod input_constants.mod atom_output.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_fit.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_fit.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod input_constants.mod periodic_table.mod base_hooks.mod lapack.mod mathconstants.mod atom_utils.mod atom_output.mod powell.mod atom_electronic_structure.mod cp_files.mod physcon.mod atom_operators.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_fit.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_fit.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod atom_operators.mod lapack.mod mathconstants.mod cp_files.mod kinds.mod atom_utils.mod input_constants.mod physcon.mod powell.mod atom_electronic_structure.mod periodic_table.mod atom_output.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_fit.F atom_fit.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:12:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_fit.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_fit.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:24:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_fit.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_fit.F90 /build/reproducible-path/cp2k-8.1/src/atom_fit.F:1855:21: 1855 | END FUNCTION rcpro @@ -41282,428 +41141,406 @@ 182 | INTEGER, ALLOCATABLE, DIMENSION(:, :) :: xtob | ^ Warning: 'xtob.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_fit.mod' due to: atom_fit.o /build/reproducible-path/cp2k-8.1/src/atom_fit.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod input_constants.mod periodic_table.mod base_hooks.mod lapack.mod mathconstants.mod atom_utils.mod atom_output.mod powell.mod atom_electronic_structure.mod cp_files.mod physcon.mod atom_operators.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_fit.mod' due to: atom_fit.o /build/reproducible-path/cp2k-8.1/src/atom_fit.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod atom_operators.mod lapack.mod mathconstants.mod cp_files.mod kinds.mod atom_utils.mod input_constants.mod physcon.mod powell.mod atom_electronic_structure.mod periodic_table.mod atom_output.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_kind_orbitals.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_kind_orbitals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rel_control_types.mod qs_kind_types.mod basis_set_types.mod atom_types.mod external_potential_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod mathconstants.mod atom_fit.mod kinds.mod atom_electronic_structure.mod physcon.mod atom_operators.mod atom_utils.mod qs_grid_atom.mod ai_onecenter.mod periodic_table.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_kind_orbitals.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_kind_orbitals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rel_control_types.mod atom_types.mod atomic_kind_types.mod basis_set_types.mod external_potential_types.mod qs_kind_types.mod input_section_types.mod kinds.mod physcon.mod periodic_table.mod ai_onecenter.mod qs_grid_atom.mod atom_fit.mod atom_utils.mod base_hooks.mod atom_operators.mod mathconstants.mod input_constants.mod atom_electronic_structure.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_kind_orbitals.F atom_kind_orbitals.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:13:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_kind_orbitals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_kind_orbitals.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_kind_orbitals.mod' due to: atom_kind_orbitals.o /build/reproducible-path/cp2k-8.1/src/atom_kind_orbitals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rel_control_types.mod qs_kind_types.mod basis_set_types.mod atom_types.mod external_potential_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod mathconstants.mod atom_fit.mod kinds.mod atom_electronic_structure.mod physcon.mod atom_operators.mod atom_utils.mod qs_grid_atom.mod ai_onecenter.mod periodic_table.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho_atom_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho_atom_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod qs_oce_types.mod cp_para_types.mod qs_environment_types.mod paw_proj_set_types.mod cp_control_types.mod qs_rho_atom_types.mod sap_kind_types.mod atomic_kind_types.mod mathconstants.mod util.mod kinds.mod qs_harmonics_atom.mod spherical_harmonics.mod message_passing.mod qs_oce_methods.mod whittaker.mod qs_grid_atom.mod memory_utilities.mod lebedev.mod base_hooks.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho_atom_methods.F qs_rho_atom_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:13:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho_atom_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho_atom_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho_atom_methods.mod' due to: qs_rho_atom_methods.o /build/reproducible-path/cp2k-8.1/src/qs_rho_atom_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod qs_oce_types.mod cp_para_types.mod qs_environment_types.mod paw_proj_set_types.mod cp_control_types.mod qs_rho_atom_types.mod sap_kind_types.mod atomic_kind_types.mod mathconstants.mod util.mod kinds.mod qs_harmonics_atom.mod spherical_harmonics.mod message_passing.mod qs_oce_methods.mod whittaker.mod qs_grid_atom.mod memory_utilities.mod lebedev.mod base_hooks.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int3_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int3_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod input_constants.mod base_hooks.mod semi_empirical_int_arrays.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_int3_utils.F semi_empirical_int3_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:13:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int3_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int3_utils.F90 -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int3_utils.F:118:32: - - 118 | add = (pij + pkl)**2 - | ^ -Warning: 'pkl' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int3_utils.F:118:32: Warning: 'pij' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_int3_utils.mod' due to: semi_empirical_int3_utils.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_int3_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod input_constants.mod base_hooks.mod semi_empirical_int_arrays.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_expns3_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_expns3_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_expns3_types.mod qs_kind_types.mod cp_control_types.mod semi_empirical_types.mod input_constants.mod semi_empirical_utils.mod base_hooks.mod semi_empirical_int_arrays.mod semi_empirical_int3_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_expns3_methods.F semi_empirical_expns3_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:13:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_expns3_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_expns3_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_expns3_methods.mod' due to: semi_empirical_expns3_methods.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_expns3_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_expns3_types.mod qs_kind_types.mod cp_control_types.mod semi_empirical_types.mod input_constants.mod semi_empirical_utils.mod base_hooks.mod semi_empirical_int_arrays.mod semi_empirical_int3_utils.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:25:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_kind_orbitals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_kind_orbitals.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_kind_orbitals.mod' due to: atom_kind_orbitals.o /build/reproducible-path/cp2k-8.1/src/atom_kind_orbitals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rel_control_types.mod atom_types.mod atomic_kind_types.mod basis_set_types.mod external_potential_types.mod qs_kind_types.mod input_section_types.mod kinds.mod physcon.mod periodic_table.mod ai_onecenter.mod qs_grid_atom.mod atom_fit.mod atom_utils.mod base_hooks.mod atom_operators.mod mathconstants.mod input_constants.mod atom_electronic_structure.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb_parameters.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb_parameters.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod cp_para_types.mod qs_dftb_types.mod cp_control_types.mod external_potential_types.mod atomic_kind_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod string_utilities.mod mathconstants.mod cp_files.mod kinds.mod qmmm_ff_fist.mod cp_output_handling.mod physcon.mod qs_dftb_utils.mod cp_parser_methods.mod message_passing.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dftb_parameters.F qs_dftb_parameters.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:13:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_parameters.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_parameters.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb_parameters.mod' due to: qs_dftb_parameters.o /build/reproducible-path/cp2k-8.1/src/qs_dftb_parameters.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod cp_para_types.mod qs_dftb_types.mod cp_control_types.mod external_potential_types.mod atomic_kind_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod string_utilities.mod mathconstants.mod cp_files.mod kinds.mod qmmm_ff_fist.mod cp_output_handling.mod physcon.mod qs_dftb_utils.mod cp_parser_methods.mod message_passing.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'sirius_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/sirius_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod atom_types.mod pwdft_environment_types.mod atomic_kind_types.mod external_potential_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod atom_upf.mod qs_grid_atom.mod atom_utils.mod base_hooks.mod mathconstants.mod input_constants.mod atom_kind_orbitals.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/sirius_interface.F sirius_interface.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:25:26 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"sirius_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' sirius_interface.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'sirius_interface.mod' due to: sirius_interface.o /build/reproducible-path/cp2k-8.1/src/sirius_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod atom_types.mod pwdft_environment_types.mod atomic_kind_types.mod external_potential_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod atom_upf.mod qs_grid_atom.mod atom_utils.mod base_hooks.mod mathconstants.mod input_constants.mod atom_kind_orbitals.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'generic_shg_integrals_init.o' due to: /build/reproducible-path/cp2k-8.1/src/shg_int/generic_shg_integrals_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod spherical_harmonics.mod base_hooks.mod mathconstants.mod orbital_pointers.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/shg_int/generic_shg_integrals_init.F generic_shg_integrals_init.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:13:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/generic_shg_integrals_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/shg_int/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' generic_shg_integrals_init.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'generic_shg_integrals_init.mod' due to: generic_shg_integrals_init.o /build/reproducible-path/cp2k-8.1/src/shg_int/generic_shg_integrals_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod spherical_harmonics.mod base_hooks.mod mathconstants.mod orbital_pointers.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_subsys_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_subsys_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod cp_para_types.mod basis_set_types.mod cp_subsys_types.mod external_potential_types.mod qs_kind_types.mod cell_types.mod input_section_types.mod qs_subsys_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod cell_methods.mod cp_subsys_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_subsys_methods.F qs_subsys_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:25:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_subsys_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_subsys_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_subsys_methods.mod' due to: qs_subsys_methods.o /build/reproducible-path/cp2k-8.1/src/qs_subsys_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod cp_para_types.mod basis_set_types.mod cp_subsys_types.mod external_potential_types.mod qs_kind_types.mod cell_types.mod input_section_types.mod qs_subsys_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod cell_methods.mod cp_subsys_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 's_contract_shg.o' due to: /build/reproducible-path/cp2k-8.1/src/shg_int/s_contract_shg.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod gamma.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/shg_int/s_contract_shg.F s_contract_shg.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:13:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/s_contract_shg.F\"" -I'/build/reproducible-path/cp2k-8.1/src/shg_int/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' s_contract_shg.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 's_contract_shg.mod' due to: s_contract_shg.o /build/reproducible-path/cp2k-8.1/src/shg_int/s_contract_shg.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod gamma.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'header.o' due to: /build/reproducible-path/cp2k-8.1/src/header.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp2k_info.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/header.F header.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:25:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"header.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' header.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'header.mod' due to: header.o /build/reproducible-path/cp2k-8.1/src/header.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp2k_info.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constants_operator.o' due to: /build/reproducible-path/cp2k-8.1/src/shg_int/constants_operator.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/shg_int/constants_operator.F constants_operator.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:14:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/constants_operator.F\"" -I'/build/reproducible-path/cp2k-8.1/src/shg_int/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constants_operator.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constants_operator.mod' due to: constants_operator.o /build/reproducible-path/cp2k-8.1/src/shg_int/constants_operator.F +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pwdft_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/pwdft_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod pwdft_environment_types.mod atomic_kind_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod qs_subsys_types.mod virial_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod cp_symmetry.mod sirius_interface.mod particle_methods.mod distribution_methods.mod machine.mod qs_subsys_methods.mod base_hooks.mod header.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pwdft_environment.F pwdft_environment.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:25:32 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pwdft_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pwdft_environment.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pwdft_environment.mod' due to: pwdft_environment.o /build/reproducible-path/cp2k-8.1/src/pwdft_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod pwdft_environment_types.mod atomic_kind_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod qs_subsys_types.mod virial_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod cp_symmetry.mod sirius_interface.mod particle_methods.mod distribution_methods.mod machine.mod qs_subsys_methods.mod base_hooks.mod header.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'construct_shg.o' due to: /build/reproducible-path/cp2k-8.1/src/shg_int/construct_shg.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod orbital_pointers.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/shg_int/construct_shg.F construct_shg.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:14:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/construct_shg.F\"" -I'/build/reproducible-path/cp2k-8.1/src/shg_int/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' construct_shg.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'construct_shg.mod' due to: construct_shg.o /build/reproducible-path/cp2k-8.1/src/shg_int/construct_shg.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod orbital_pointers.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'nnp_acsf.o' due to: /build/reproducible-path/cp2k-8.1/src/nnp_acsf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod nnp_environment_types.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod periodic_table.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/nnp_acsf.F nnp_acsf.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:25:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_acsf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_acsf.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'nnp_acsf.mod' due to: nnp_acsf.o /build/reproducible-path/cp2k-8.1/src/nnp_acsf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod nnp_environment_types.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod periodic_table.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'generic_shg_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/shg_int/generic_shg_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod s_contract_shg.mod constants_operator.mod construct_shg.mod orbital_pointers.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/shg_int/generic_shg_integrals.F generic_shg_integrals.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:14:16 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/generic_shg_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/shg_int/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' generic_shg_integrals.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'generic_shg_integrals.mod' due to: generic_shg_integrals.o /build/reproducible-path/cp2k-8.1/src/shg_int/generic_shg_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod base_hooks.mod s_contract_shg.mod constants_operator.mod construct_shg.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'nnp_model.o' due to: /build/reproducible-path/cp2k-8.1/src/nnp_model.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod nnp_environment_types.mod cp_log_handling.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/nnp_model.F nnp_model.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:25:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_model.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_model.F90 +/build/reproducible-path/cp2k-8.1/src/nnp_model.F:186:94: + + 186 | arc%layer(i)%node_grad(j) = -1.0_dp*arc%layer(i)%node(j)*arc%layer(i)%node_grad(j) + | ^ +Warning: 'j' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'nnp_model.mod' due to: nnp_model.o /build/reproducible-path/cp2k-8.1/src/nnp_model.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod nnp_environment_types.mod cp_log_handling.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_environment_init.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_environment_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod basis_set_types.mod atomic_kind_types.mod input_section_types.mod qs_kind_types.mod qs_environment_types.mod cp_control_types.mod ao_util.mod mathlib.mod mathconstants.mod base_hooks.mod generic_shg_integrals_init.mod generic_shg_integrals.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_environment_init.F lri_environment_init.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:14:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_environment_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_environment_init.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_environment_init.mod' due to: lri_environment_init.o /build/reproducible-path/cp2k-8.1/src/lri_environment_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod basis_set_types.mod atomic_kind_types.mod input_section_types.mod qs_kind_types.mod qs_environment_types.mod cp_control_types.mod ao_util.mod mathlib.mod mathconstants.mod base_hooks.mod generic_shg_integrals_init.mod generic_shg_integrals.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'nnp_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/nnp_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod cell_types.mod cp_parser_types.mod nnp_environment_types.mod molecule_types.mod atomic_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod periodic_table.mod bibliography.mod cell_methods.mod cp_subsys_methods.mod particle_methods.mod nnp_acsf.mod nnp_model.mod distribution_methods.mod base_hooks.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/nnp_environment.F nnp_environment.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:25:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_environment.F90 +/build/reproducible-path/cp2k-8.1/src/nnp_environment.F:734:68: + + 734 | WRITE (unit_nr, *) "NNP| NNP force environment initialized" + | ^ +Warning: 'unit_nr' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'nnp_environment.mod' due to: nnp_environment.o /build/reproducible-path/cp2k-8.1/src/nnp_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod cell_types.mod cp_parser_types.mod nnp_environment_types.mod molecule_types.mod atomic_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod periodic_table.mod bibliography.mod cell_methods.mod cp_subsys_methods.mod particle_methods.mod nnp_acsf.mod nnp_model.mod distribution_methods.mod base_hooks.mod cp_parser_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_write_output.o' due to: /build/reproducible-path/cp2k-8.1/src/xc_write_output.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod base_hooks.mod xc_derivatives.mod xc_libxc.mod input_cp2k_check.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc_write_output.F xc_write_output.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:14:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc_write_output.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_write_output.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_write_output.mod' due to: xc_write_output.o /build/reproducible-path/cp2k-8.1/src/xc_write_output.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod base_hooks.mod xc_derivatives.mod xc_libxc.mod input_cp2k_check.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_util.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qmmm_types.mod cp_subsys_types.mod input_section_types.mod fist_environment_types.mod qs_kind_types.mod qs_energy_types.mod particle_types.mod cell_types.mod force_env_types.mod cp_log_handling.mod kinds.mod mathconstants.mod input_constants.mod particle_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_util.F qmmm_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:26:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_util.mod' due to: qmmm_util.o /build/reproducible-path/cp2k-8.1/src/qmmm_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qmmm_types.mod cp_subsys_types.mod input_section_types.mod fist_environment_types.mod qs_kind_types.mod qs_energy_types.mod particle_types.mod cell_types.mod force_env_types.mod cp_log_handling.mod kinds.mod mathconstants.mod input_constants.mod particle_methods.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mo_occupation.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mo_occupation.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod xas_env_types.mod qs_mo_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod fermi_utils.mod util.mod kinds.mod kahan_sum.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_mo_occupation.F qs_mo_occupation.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:14:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mo_occupation.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mo_occupation.F90 -/build/reproducible-path/cp2k-8.1/src/qs_mo_occupation.F:157:26: - - 157 | homo_a = lfomo_a - 1 - | ^ -Warning: 'lfomo_a' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_occupation.F:164:26: - - 164 | homo_b = lfomo_b - 1 - | ^ -Warning: 'lfomo_b' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mo_occupation.mod' due to: qs_mo_occupation.o /build/reproducible-path/cp2k-8.1/src/qs_mo_occupation.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod xas_env_types.mod qs_mo_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod fermi_utils.mod util.mod kinds.mod kahan_sum.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'virial_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/virial_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_list_types.mod atomic_kind_list_types.mod cell_types.mod distribution_1d_types.mod particle_types.mod virial_types.mod atomic_kind_types.mod mathlib.mod message_passing.mod kinds.mod base_hooks.mod physcon.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/virial_methods.F virial_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:26:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"virial_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' virial_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'virial_methods.mod' due to: virial_methods.o /build/reproducible-path/cp2k-8.1/src/virial_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_list_types.mod atomic_kind_list_types.mod cell_types.mod distribution_1d_types.mod particle_types.mod virial_types.mod atomic_kind_types.mod mathlib.mod message_passing.mod kinds.mod base_hooks.mod physcon.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_cfm_diag.mod' due to: cp_cfm_diag.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmmx_util.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmmx_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod molecule_types.mod particle_list_types.mod qmmmx_types.mod atomic_kind_types.mod qmmm_types.mod input_section_types.mod molecule_list_types.mod fist_neighbor_list_types.mod fist_neighbor_lists.mod cp_log_handling.mod kinds.mod qmmm_util.mod qmmm_ff_fist.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmmx_util.F qmmmx_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:26:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmmx_util.mod' due to: qmmmx_util.o /build/reproducible-path/cp2k-8.1/src/qmmmx_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod molecule_types.mod particle_list_types.mod qmmmx_types.mod atomic_kind_types.mod qmmm_types.mod input_section_types.mod molecule_list_types.mod fist_neighbor_list_types.mod fist_neighbor_lists.mod cp_log_handling.mod kinds.mod qmmm_util.mod qmmm_ff_fist.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_diag.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_diag.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_para_types.mod cp_cfm_types.mod base_hooks.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod cp_cfm_diag.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_diag.F cp_dbcsr_diag.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:14:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_diag.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_diag.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_diag.mod' due to: cp_dbcsr_diag.o /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_diag.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod cp_para_types.mod cp_cfm_types.mod base_hooks.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod cp_cfm_diag.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'd3_poly.mod' due to: d3_poly.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'admm_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/admm_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod input_constants.mod base_hooks.mod cp_gemm_interface.mod cp_dbcsr_operations.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/admm_utils.F admm_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:14:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'admm_utils.mod' due to: admm_utils.o /build/reproducible-path/cp2k-8.1/src/admm_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod input_constants.mod base_hooks.mod cp_gemm_interface.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_qmmm_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_qmmm_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pw_env_types.mod qmmm_types_low.mod pw_pool_types.mod cp_control_types.mod pw_types.mod qs_ks_qmmm_types.mod input_section_types.mod cube_utils.mod cp_log_handling.mod kinds.mod pw_methods.mod input_constants.mod d3_poly.mod cp_output_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ks_qmmm_methods.F qs_ks_qmmm_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:26:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_qmmm_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_qmmm_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_qmmm_methods.mod' due to: qs_ks_qmmm_methods.o /build/reproducible-path/cp2k-8.1/src/qs_ks_qmmm_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pw_env_types.mod qmmm_types_low.mod pw_pool_types.mod cp_control_types.mod pw_types.mod qs_ks_qmmm_types.mod input_section_types.mod cube_utils.mod cp_log_handling.mod kinds.mod pw_methods.mod input_constants.mod d3_poly.mod cp_output_handling.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mo_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mo_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_mo_types.mod cp_para_types.mod cp_fm_types.mod scf_control_types.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_diag.mod kinds.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod message_passing.mod admm_utils.mod cp_fm_cholesky.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_mo_methods.F qs_mo_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:14:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mo_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mo_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mo_methods.mod' due to: qs_mo_methods.o /build/reproducible-path/cp2k-8.1/src/qs_mo_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_mo_types.mod cp_para_types.mod cp_fm_types.mod scf_control_types.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_diag.mod kinds.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod message_passing.mod admm_utils.mod cp_fm_cholesky.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_gks.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_gks.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod dg_rho0_types.mod pw_grid_types.mod pw_pool_types.mod semi_empirical_mpole_types.mod multipole_types.mod dg_types.mod mathconstants.mod kinds.mod semi_empirical_int_arrays.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_gks.F semi_empirical_int_gks.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:26:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_gks.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_gks.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_gks.mod' due to: semi_empirical_int_gks.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_gks.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod dg_rho0_types.mod pw_grid_types.mod pw_pool_types.mod semi_empirical_mpole_types.mod multipole_types.mod dg_types.mod mathconstants.mod kinds.mod semi_empirical_int_arrays.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mo_io.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mo_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_dftb_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod string_utilities.mod cp_files.mod kinds.mod kahan_sum.mod cp_output_handling.mod cp_dbcsr_operations.mod physcon.mod qs_dftb_utils.mod message_passing.mod orbital_symbols.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod orbital_transformation_matrices.mod qs_mo_methods.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_mo_io.F qs_mo_io.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:14:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mo_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mo_io.F90 -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:679:32: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int3_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int3_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod kinds.mod input_constants.mod semi_empirical_int_arrays.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_int3_utils.F semi_empirical_int3_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:26:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int3_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int3_utils.F90 +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int3_utils.F:118:32: - 679 | nspin_read, offset_read, source + 118 | add = (pij + pkl)**2 | ^ -Warning: 'offset_read' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:871:31: +Warning: 'pkl' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int3_utils.F:118:32: Warning: 'pij' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_int3_utils.mod' due to: semi_empirical_int3_utils.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_int3_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod kinds.mod input_constants.mod semi_empirical_int_arrays.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_debug.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod semi_empirical_int3_utils.mod kinds.mod input_constants.mod semi_empirical_int_arrays.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F semi_empirical_int_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:26:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_utils.F90 +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1214:38: - 871 | IF (minbas) THEN - | ^ -Warning: 'minbas' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:922:48: + 1214 | add = (pij + pkl)**2 + | ^ +Warning: 'pkl' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1214:38: Warning: 'pij' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:314:38: - 922 | READ (rst_unit) vecbuffer_read - | ^ -Warning: 'vecbuffer_read.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:685:85: + 314 | add = (pij + pkl)**2 + | ^ +Warning: 'pkl' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:314:38: Warning: 'pij' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:841:24: - 685 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: vecbuffer, vecbuffer_read - | ^ -Warning: 'vecbuffer_read.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:682:81: + 841 | fact = fact*0.5_dp + | ^ +Warning: 'fact' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:875:37: - 682 | INTEGER, DIMENSION(:, :, :), POINTER :: nso_info, offset_info - | ^ -Warning: 'offset_info.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:879:89: + 875 | IF (l1 == 0 .AND. l2 == 2 .AND. (m2 == CLMyy .OR. m2 == CLMxx)) THEN + | ^ +Warning: 'm2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:940:37: - 879 | offset_read = offset_info(ishell_read, iset_read, iatom) - | ^ -Warning: 'offset_info.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:682:81: + 940 | IF (l1 == 2 .AND. l2 == 2 .AND. (((m1 == CLMyy) .AND. (m2 == CLMyy)) .OR. ((m1 == CLMxx) .AND. (m2 == CLMxx)))) THEN + | ^ +Warning: 'm1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:843:23: - 682 | INTEGER, DIMENSION(:, :, :), POINTER :: nso_info, offset_info - | ^ -Warning: 'offset_info.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:953:33: + 843 | IF (l1 == 0 .AND. l2 == 0) THEN + | ^ +Warning: 'l2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:849:37: - 953 | DEALLOCATE (offset_info) - | ^ -Warning: 'offset_info.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:682:68: + 849 | IF (l1 == 0 .AND. l2 == 1 .AND. m2 == CLMz) THEN + | ^ +Warning: 'l1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:920:23: - 682 | INTEGER, DIMENSION(:, :, :), POINTER :: nso_info, offset_info - | ^ -Warning: 'nso_info.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:878:34: + 920 | db = db/2.0_dp + | ^ +Warning: 'db' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:923:109: - 878 | IF (nso(lshell) == nso_info(ishell_read, iset_read, iatom)) THEN - | ^ -Warning: 'nso_info.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:682:68: + 923 | + add0/SQRT((r - db)**2 + (da + db)**2 + add)**3 - add0/SQRT((r + db)**2 + (da + db)**2 + add)**3 + | ^ +Warning: 'da' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:670:37: - 682 | INTEGER, DIMENSION(:, :, :), POINTER :: nso_info, offset_info - | ^ -Warning: 'nso_info.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:878:34: + 670 | IF (l1 == 0 .AND. l2 == 2 .AND. (m2 == CLMyy .OR. m2 == CLMxx)) THEN + | ^ +Warning: 'm2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:735:37: - 878 | IF (nso(lshell) == nso_info(ishell_read, iset_read, iatom)) THEN + 735 | IF (l1 == 2 .AND. l2 == 2 .AND. (((m1 == CLMyy) .AND. (m2 == CLMyy)) .OR. ((m1 == CLMxx) .AND. (m2 == CLMxx)))) THEN + | ^ +Warning: 'm1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:638:23: + + 638 | IF (l1 == 0 .AND. l2 == 0) THEN + | ^ +Warning: 'l2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:644:37: + + 644 | IF (l1 == 0 .AND. l2 == 1 .AND. m2 == CLMz) THEN + | ^ +Warning: 'l1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:640:28: + + 640 | charg = -charg*fact + | ^ +Warning: 'fact' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:715:23: + + 715 | db = db/2.0_dp + | ^ +Warning: 'db' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:718:117: + + 718 | + (r - db)/SQRT((r - db)**2 + (da + db)**2 + add)**3 - (r + db)/SQRT((r + db)**2 + (da + db)**2 + add)**3 + | ^ +Warning: 'da' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:467:37: + + 467 | IF (l1 == 0 .AND. l2 == 2 .AND. (m2 == CLMyy .OR. m2 == CLMxx)) THEN + | ^ +Warning: 'm2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:533:37: + + 533 | IF (l1 == 2 .AND. l2 == 2 .AND. (((m1 == CLMyy) .AND. (m2 == CLMyy)) .OR. ((m1 == CLMxx) .AND. (m2 == CLMxx)))) THEN + | ^ +Warning: 'm1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:436:23: + + 436 | IF (l1 == 0 .AND. l2 == 0) THEN + | ^ +Warning: 'l2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:441:37: + + 441 | IF (l1 == 0 .AND. l2 == 1 .AND. m2 == CLMz) THEN + | ^ +Warning: 'l1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:443:34: + + 443 | charg = charg*0.5_dp*fact | ^ -Warning: 'nso_info.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:681:74: +Warning: 'fact' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:513:23: - 681 | INTEGER, DIMENSION(:, :), POINTER :: l, nshell_info - | ^ -Warning: 'nshell_info.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:681:74: Warning: 'nshell_info.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:681:74: Warning: 'nshell_info.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:680:69: + 513 | db = db/2.0_dp + | ^ +Warning: 'db' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:516:107: - 680 | INTEGER, DIMENSION(:), POINTER :: nset_info, nshell - | ^ -Warning: 'nset_info.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:1013:67: + 516 | + 1.0_dp/SQRT((r - db)**2 + (da + db)**2 + add) - 1.0_dp/SQRT((r + db)**2 + (da + db)**2 + add) + | ^ +Warning: 'da' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1958:60: - 1013 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cmatrix, smatrix - | ^ -Warning: 'cmatrix.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:1013:67: Warning: 'cmatrix.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mo_io.mod' due to: qs_mo_io.o /build/reproducible-path/cp2k-8.1/src/qs_mo_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_dftb_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod string_utilities.mod cp_files.mod kinds.mod kahan_sum.mod cp_output_handling.mod cp_dbcsr_operations.mod physcon.mod qs_dftb_utils.mod message_passing.mod orbital_symbols.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod orbital_transformation_matrices.mod qs_mo_methods.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_output.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_output.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod cp_para_types.mod qs_kind_types.mod particle_types.mod qs_environment_types.mod cp_fm_types.mod mathlib.mod cp_log_handling.mod message_passing.mod base_hooks.mod machine.mod orbital_pointers.mod kinds.mod particle_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_output.F cp_dbcsr_output.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:14:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_output.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_output.F90 -/build/reproducible-path/cp2k-8.1/src/cp_dbcsr_output.F:245:10: + 1958 | d_d(:, 1, 5) = pt5sq3*(s2a_d*sb2 + s2a*sb2_d) + | ^ +Warning: 'sb2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1959:60: - 245 | IF (print_sym) THEN - | ^ -Warning: 'print_sym' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_output.mod' due to: cp_dbcsr_output.o /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_output.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod cp_para_types.mod qs_kind_types.mod particle_types.mod qs_environment_types.mod cp_fm_types.mod mathlib.mod cp_log_handling.mod message_passing.mod base_hooks.mod machine.mod orbital_pointers.mod kinds.mod particle_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'task_list_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/task_list_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/array_sort.fypp realspace_grid_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod pw_env_types.mod cp_control_types.mod particle_types.mod qs_ks_types.mod task_list_types.mod cube_utils.mod util.mod kinds.mod grid_api.mod ao_util.mod gaussian_gridlevels.mod message_passing.mod particle_methods.mod memory_utilities.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/task_list_methods.F task_list_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:15:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"task_list_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' task_list_methods.F90 -/build/reproducible-path/cp2k-8.1/src/task_list_methods.F:1015:66: + 1959 | d_d(:, 2, 5) = 0.5_dp*(s2a_d*s2b + s2a*s2b_d) + | ^ +Warning: 's2b' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1961:83: - 1015 | ilocal, k, maxdest, Ncpu, Nflux - | ^ -Warning: 'ilocal' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/task_list_methods.F:402:46: + 1961 | d_d(:, 4, 5) = s2a_d*(cb2 + 0.5_dp*sb2) + s2a*(cb2_d + 0.5_dp*sb2_d) + | ^ +Warning: 's2a' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1941:83: - 402 | task_list%npairs(igrid_level) = ipair - | ^ -Warning: 'igrid_level' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'task_list_methods.mod' due to: task_list_methods.o /build/reproducible-path/cp2k-8.1/src/task_list_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/array_sort.fypp realspace_grid_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod pw_env_types.mod cp_control_types.mod particle_types.mod qs_ks_types.mod task_list_types.mod cube_utils.mod util.mod kinds.mod grid_api.mod ao_util.mod gaussian_gridlevels.mod message_passing.mod particle_methods.mod memory_utilities.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rs_pw_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/pw_env/rs_pw_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod input_section_types.mod pw_types.mod pw_pool_types.mod pw_env_types.mod pw_methods.mod gaussian_gridlevels.mod cp_log_handling.mod base_hooks.mod cp_spline_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw_env/rs_pw_interface.F rs_pw_interface.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:15:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env/rs_pw_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw_env/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rs_pw_interface.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rs_pw_interface.mod' due to: rs_pw_interface.o /build/reproducible-path/cp2k-8.1/src/pw_env/rs_pw_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod input_section_types.mod pw_types.mod pw_pool_types.mod pw_env_types.mod pw_methods.mod gaussian_gridlevels.mod cp_log_handling.mod base_hooks.mod cp_spline_utils.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_integrate_potential_product.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential_product.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod admm_types.mod pw_types.mod cell_types.mod qs_kind_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod qs_force_types.mod task_list_types.mod input_constants.mod task_list_methods.mod cube_utils.mod kinds.mod rs_pw_interface.mod grid_api.mod gaussian_gridlevels.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential_product.F qs_integrate_potential_product.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:15:16 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_integrate_potential_product.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_integrate_potential_product.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_integrate_potential_product.mod' due to: qs_integrate_potential_product.o /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential_product.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod admm_types.mod pw_types.mod cell_types.mod qs_kind_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod qs_force_types.mod task_list_types.mod input_constants.mod task_list_methods.mod cube_utils.mod kinds.mod rs_pw_interface.mod grid_api.mod gaussian_gridlevels.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_integrate_potential_single.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential_single.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod cell_types.mod qs_kind_types.mod lri_environment_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod external_potential_types.mod atprop_types.mod atomic_kind_types.mod qs_force_types.mod kinds.mod rs_pw_interface.mod grid_api.mod ao_util.mod gaussian_gridlevels.mod message_passing.mod memory_utilities.mod base_hooks.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential_single.F qs_integrate_potential_single.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:15:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_integrate_potential_single.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_integrate_potential_single.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_integrate_potential_single.mod' due to: qs_integrate_potential_single.o /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential_single.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod cell_types.mod qs_kind_types.mod lri_environment_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod external_potential_types.mod atprop_types.mod atomic_kind_types.mod qs_force_types.mod kinds.mod rs_pw_interface.mod grid_api.mod ao_util.mod gaussian_gridlevels.mod message_passing.mod memory_utilities.mod base_hooks.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_integrate_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 grid_api.mod qs_integrate_potential_product.mod qs_integrate_potential_single.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential.F qs_integrate_potential.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:15:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_integrate_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_integrate_potential.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_integrate_potential.mod' due to: qs_integrate_potential.o /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 grid_api.mod qs_integrate_potential_product.mod qs_integrate_potential_single.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_collocate_density.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_collocate_density.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod lri_environment_types.mod basis_set_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod external_potential_types.mod cp_fm_types.mod atomic_kind_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod task_list_methods.mod pw_methods.mod cube_utils.mod kinds.mod rs_pw_interface.mod grid_api.mod cp_dbcsr_operations.mod ao_util.mod gaussian_gridlevels.mod memory_utilities.mod base_hooks.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_collocate_density.F qs_collocate_density.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:15:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_collocate_density.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_collocate_density.F90 -/build/reproducible-path/cp2k-8.1/src/qs_collocate_density.F:1926:10: + 1941 | d_d(:, 4, 1) = c2a_d*(cb2 + 0.5_dp*sb2) + c2a*(cb2_d + 0.5_dp*sb2_d) + | ^ +Warning: 'cb2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1954:49: - 1926 | IF (distributed_rs_grids) THEN - | ^ -Warning: 'distributed_rs_grids' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_collocate_density.mod' due to: qs_collocate_density.o /build/reproducible-path/cp2k-8.1/src/qs_collocate_density.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod lri_environment_types.mod basis_set_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod external_potential_types.mod cp_fm_types.mod atomic_kind_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod task_list_methods.mod pw_methods.mod cube_utils.mod kinds.mod rs_pw_interface.mod grid_api.mod cp_dbcsr_operations.mod ao_util.mod gaussian_gridlevels.mod memory_utilities.mod base_hooks.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_image_charge.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_image_charge.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod cell_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod pw_poisson_types.mod pw_pool_types.mod input_section_types.mod qmmm_types_low.mod qs_energy_types.mod input_constants.mod pw_methods.mod mathconstants.mod cp_files.mod util.mod kinds.mod pw_poisson_methods.mod qs_integrate_potential.mod cp_output_handling.mod ao_util.mod message_passing.mod qs_collocate_density.mod eri_mme_integrate.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod cp_eri_mme_interface.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_image_charge.F qmmm_image_charge.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:15:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_image_charge.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_image_charge.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_image_charge.mod' due to: qmmm_image_charge.o /build/reproducible-path/cp2k-8.1/src/qmmm_image_charge.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod cell_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod pw_poisson_types.mod pw_pool_types.mod input_section_types.mod qmmm_types_low.mod qs_energy_types.mod input_constants.mod pw_methods.mod mathconstants.mod cp_files.mod util.mod kinds.mod pw_poisson_methods.mod qs_integrate_potential.mod cp_output_handling.mod ao_util.mod message_passing.mod qs_collocate_density.mod eri_mme_integrate.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod cp_eri_mme_interface.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_output.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_output.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod qs_kind_types.mod qs_cdft_opt_types.mod cp_para_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod ps_implicit_types.mod pw_poisson_types.mod qs_scf_types.mod atomic_kind_types.mod qs_charges_types.mod scf_control_types.mod input_section_types.mod qs_energy_types.mod input_constants.mod kinds.mod kahan_sum.mod qs_mo_io.mod cp_output_handling.mod physcon.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod qs_mo_methods.mod machine.mod cp_units.mod qmmm_image_charge.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_output.F qs_scf_output.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:15:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_output.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_output.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_output.mod' due to: qs_scf_output.o /build/reproducible-path/cp2k-8.1/src/qs_scf_output.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod qs_kind_types.mod qs_cdft_opt_types.mod cp_para_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod ps_implicit_types.mod pw_poisson_types.mod qs_scf_types.mod atomic_kind_types.mod qs_charges_types.mod scf_control_types.mod input_section_types.mod qs_energy_types.mod input_constants.mod kinds.mod kahan_sum.mod qs_mo_io.mod cp_output_handling.mod physcon.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod qs_mo_methods.mod machine.mod cp_units.mod qmmm_image_charge.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hirshfeld_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hirshfeld_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod hirshfeld_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod atomic_kind_types.mod input_constants.mod pw_methods.mod mathconstants.mod cube_utils.mod kinds.mod grid_api.mod ao_util.mod message_passing.mod periodic_table.mod base_hooks.mod atom_kind_orbitals.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hirshfeld_methods.F hirshfeld_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:16:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hirshfeld_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hirshfeld_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hirshfeld_methods.mod' due to: hirshfeld_methods.o /build/reproducible-path/cp2k-8.1/src/hirshfeld_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod hirshfeld_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod atomic_kind_types.mod input_constants.mod pw_methods.mod mathconstants.mod cube_utils.mod kinds.mod grid_api.mod ao_util.mod message_passing.mod periodic_table.mod base_hooks.mod atom_kind_orbitals.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'realspace_grid_cube.mod' due to: realspace_grid_cube.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_realspace_grid_cube.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_realspace_grid_cube.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod pw_types.mod particle_list_types.mod realspace_grid_cube.mod base_hooks.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_realspace_grid_cube.F cp_realspace_grid_cube.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:16:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_realspace_grid_cube.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_realspace_grid_cube.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_realspace_grid_cube.mod' due to: cp_realspace_grid_cube.o /build/reproducible-path/cp2k-8.1/src/cp_realspace_grid_cube.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod pw_types.mod particle_list_types.mod realspace_grid_cube.mod base_hooks.mod cp_output_handling.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_cdft_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_cdft_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod hirshfeld_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod particle_list_types.mod atomic_kind_types.mod input_section_types.mod outer_scf_control_types.mod input_constants.mod kinds.mod qs_scf_output.mod grid_api.mod cp_output_handling.mod ao_util.mod bibliography.mod memory_utilities.mod hirshfeld_methods.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_cdft_utils.F qs_cdft_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:16:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_utils.F90 -/build/reproducible-path/cp2k-8.1/src/qs_cdft_utils.F:925:54: + 1954 | d_d(:, 2, 4) = sa_d*c2b + sa*c2b_d + | ^ +Warning: 'c2b' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1941:83: - 925 | nzeroed_inner = nzeroed_inner + 1 - | ^ -Warning: 'nzeroed_inner' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_cdft_utils.F:935:48: + 1941 | d_d(:, 4, 1) = c2a_d*(cb2 + 0.5_dp*sb2) + c2a*(cb2_d + 0.5_dp*sb2_d) + | ^ +Warning: 'c2a' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1911:37: - 935 | nzeroed = nzeroed + nzeroed_inner - | ^ -Warning: 'nzeroed' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_cdft_utils.mod' due to: qs_cdft_utils.o /build/reproducible-path/cp2k-8.1/src/qs_cdft_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod hirshfeld_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod particle_list_types.mod atomic_kind_types.mod input_section_types.mod outer_scf_control_types.mod input_constants.mod kinds.mod qs_scf_output.mod grid_api.mod cp_output_handling.mod ao_util.mod bibliography.mod memory_utilities.mod hirshfeld_methods.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_control_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_control_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_enumeration_types.mod pair_potential_types.mod cp_control_types.mod xc_rho_cflags_types.mod input_section_types.mod input_constants.mod string_utilities.mod mathconstants.mod xc_write_output.mod cp_files.mod input_cp2k_check.mod util.mod kinds.mod xc_input_constants.mod force_fields_input.mod cp_output_handling.mod xc_derivatives.mod bibliography.mod qs_cdft_utils.mod periodic_table.mod cp_log_handling.mod base_hooks.mod input_cp2k_dft.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_control_utils.F cp_control_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:16:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_control_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_control_utils.F90 -/build/reproducible-path/cp2k-8.1/src/cp_control_utils.F:1677:51: + 1911 | r_d = (/x11, x22, x33/)/r + | ^ +Warning: 'x33' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1700:80: - 1677 | method = enum_i2c(enum, qs_control%method_id) - | 1 -Warning: CHARACTER expression will be truncated in assignment (20/80) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/src/cp_control_utils.F:1682:69: + 1700 | sqb, sqb2i, x11, x22, x33 + | ^ +Warning: 'x22' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1700:75: - 1682 | quadrature = enum_i2c(enum, qs_control%gapw_control%quadrature) - | 1 -Warning: CHARACTER expression will be truncated in assignment (20/80) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/src/cp_control_utils.F:208:53: + 1700 | sqb, sqb2i, x11, x22, x33 + | ^ +Warning: 'x11' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1919:42: - 208 | dft_control%auto_basis_aux_fit = isize - | ^ -Warning: 'isize' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_control_utils.mod' due to: cp_control_utils.o /build/reproducible-path/cp2k-8.1/src/cp_control_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_enumeration_types.mod pair_potential_types.mod cp_control_types.mod xc_rho_cflags_types.mod input_section_types.mod input_constants.mod string_utilities.mod mathconstants.mod xc_write_output.mod cp_files.mod input_cp2k_check.mod util.mod kinds.mod xc_input_constants.mod force_fields_input.mod cp_output_handling.mod xc_derivatives.mod bibliography.mod qs_cdft_utils.mod periodic_table.mod cp_log_handling.mod base_hooks.mod input_cp2k_dft.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_min_heap.mod' due to: cp_min_heap.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'distribution_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/distribution_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod cell_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod particle_types.mod molecule_kind_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod input_constants.mod mathconstants.mod cp_blacs_env.mod util.mod kinds.mod cp_min_heap.mod cp_output_handling.mod cp_array_utils.mod message_passing.mod mathlib.mod cp_log_handling.mod base_hooks.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/distribution_methods.F distribution_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:16:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"distribution_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' distribution_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'distribution_methods.mod' due to: distribution_methods.o /build/reproducible-path/cp2k-8.1/src/distribution_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod cell_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod particle_types.mod molecule_kind_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod input_constants.mod mathconstants.mod cp_blacs_env.mod util.mod kinds.mod cp_min_heap.mod cp_output_handling.mod cp_array_utils.mod message_passing.mod mathlib.mod cp_log_handling.mod base_hooks.mod machine.mod + 1919 | sb_d = (sqb_d*r - sqb*r_d)*r2i + | ^ +Warning: 'sqb' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_utils.mod' due to: semi_empirical_int_utils.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_debug.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod semi_empirical_int3_utils.mod kinds.mod input_constants.mod semi_empirical_int_arrays.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'd3_poly.mod' due to: d3_poly.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_num.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_num.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_args.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod multipole_types.mod taper_types.mod kinds.mod input_constants.mod physcon.mod semi_empirical_int_arrays.mod semi_empirical_int_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_num.F semi_empirical_int_num.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:26:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_num.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_num.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_num.mod' due to: semi_empirical_int_num.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_num.F /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_args.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod multipole_types.mod taper_types.mod kinds.mod input_constants.mod physcon.mod semi_empirical_int_arrays.mod semi_empirical_int_utils.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_env_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw_env_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dielectric_types.mod realspace_grid_types.mod cell_types.mod qs_kind_types.mod qs_dispersion_types.mod basis_set_types.mod ps_wavelet_types.mod cp_para_types.mod qs_rho0_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod ps_implicit_types.mod pw_poisson_types.mod pw_pool_types.mod input_section_types.mod pw_grid_types.mod input_constants.mod cp_realspace_grid_init.mod pw_grids.mod cube_utils.mod kinds.mod pw_poisson_methods.mod xc_input_constants.mod d3_poly.mod cp_output_handling.mod ao_util.mod gaussian_gridlevels.mod dct.mod cp_log_handling.mod base_hooks.mod pw_grid_info.mod pw_poisson_read_input.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw_env_methods.F pw_env_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:16:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_env_methods.F90 -/build/reproducible-path/cp2k-8.1/src/pw_env_methods.F:1028:45: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_ana.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_debug.f90 /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_args.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod multipole_types.mod taper_types.mod kinds.mod input_constants.mod physcon.mod semi_empirical_int_arrays.mod semi_empirical_int_utils.mod semi_empirical_int_num.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F semi_empirical_int_ana.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:26:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_ana.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_ana.F90 +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F:522:93: - 1028 | 1, (/-1, -1, -1/)) - | ^ -Warning: 'border_points' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/pw_env_methods.F:797:16: + 522 | dscale = dscale + dzz*fnj1(ig)*EXP(-ax) - dax*zz*fnj1(ig)*EXP(-ax) + | ^ +Warning: 'dzz' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F:422:73: - 797 | IF (igrid_zet0_s == igrid_level) maxradius = MAX(maxradius, max_rpgf0_s) - | ^ -Warning: 'igrid_zet0_s' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/pw_env_methods.F:751:67: + 422 | dscale = SIGN(1.0_dp, scale*tmp)*(dscale*tmp + scale*dtmp) + | ^ +Warning: 'dtmp' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F:216:57: - 751 | INTEGER :: handle, ibasis_set_type, igrid_level, igrid_zet0_s, ikind, ipgf, iset, ishell, & - | ^ -note: 'igrid_zet0_s' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_env_methods.mod' due to: pw_env_methods.o /build/reproducible-path/cp2k-8.1/src/pw_env_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dielectric_types.mod realspace_grid_types.mod cell_types.mod qs_kind_types.mod qs_dispersion_types.mod basis_set_types.mod ps_wavelet_types.mod cp_para_types.mod qs_rho0_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod ps_implicit_types.mod pw_poisson_types.mod pw_pool_types.mod input_section_types.mod pw_grid_types.mod input_constants.mod cp_realspace_grid_init.mod pw_grids.mod cube_utils.mod kinds.mod pw_poisson_methods.mod xc_input_constants.mod d3_poly.mod cp_output_handling.mod ao_util.mod gaussian_gridlevels.mod dct.mod cp_log_handling.mod base_hooks.mod pw_grid_info.mod pw_poisson_read_input.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewald_pw_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/ewald_pw_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dg_types.mod ewald_pw_types.mod pw_poisson_types.mod input_section_types.mod pw_pool_types.mod pw_grid_types.mod ewald_environment_types.mod dg_rho0_types.mod pw_poisson_methods.mod base_hooks.mod pw_grids.mod dgs.mod pw_poisson_read_input.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewald_pw_methods.F ewald_pw_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:16:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_pw_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_pw_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewald_pw_methods.mod' due to: ewald_pw_methods.o /build/reproducible-path/cp2k-8.1/src/ewald_pw_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dg_types.mod ewald_pw_types.mod pw_poisson_types.mod input_section_types.mod pw_pool_types.mod pw_grid_types.mod ewald_environment_types.mod dg_rho0_types.mod pw_poisson_methods.mod base_hooks.mod pw_grids.mod dgs.mod pw_poisson_read_input.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_density_mixing_types.mod qs_mo_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod message_passing.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_fm_cholesky.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_methods.F qs_scf_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:16:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_methods.mod' due to: qs_scf_methods.o /build/reproducible-path/cp2k-8.1/src/qs_scf_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_density_mixing_types.mod qs_mo_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod message_passing.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_fm_cholesky.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mixing_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mixing_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cp_para_types.mod pw_types.mod qs_rho_atom_types.mod qs_neighbor_list_types.mod qs_density_mixing_types.mod qs_environment_types.mod cp_control_types.mod distribution_1d_types.mod base_hooks.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod kinds.mod qs_scf_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_mixing_utils.F qs_mixing_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:16:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mixing_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mixing_utils.F90 -/build/reproducible-path/cp2k-8.1/src/qs_mixing_utils.F:125:80: + 216 | tmp_d(3, m) = dcore(1, n)*drij(3) + | ^ +Warning: 'drij[2]' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F:215:57: - 125 | max_shell, na, natom, nbuffer, nel, & - | ^ -Warning: 'natom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mixing_utils.F:233:39: + 215 | tmp_d(2, m) = dcore(1, n)*drij(2) + | ^ +Warning: 'drij[1]' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F:214:57: - 233 | mixing_store%ubroy = 0.0_dp - | ^ -Warning: 'na' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_mixing_utils.F:229:66: + 214 | tmp_d(1, m) = dcore(1, n)*drij(1) + | ^ +Warning: 'drij[0]' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_ana.mod' due to: semi_empirical_int_ana.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_debug.f90 /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_args.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod multipole_types.mod taper_types.mod kinds.mod input_constants.mod physcon.mod semi_empirical_int_arrays.mod semi_empirical_int_utils.mod semi_empirical_int_num.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod semi_empirical_store_int_types.mod semi_empirical_int_gks.mod kinds.mod input_constants.mod semi_empirical_int_ana.mod semi_empirical_int_num.mod hfx_compression_methods.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_integrals.F semi_empirical_integrals.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:26:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_integrals.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_integrals.mod' due to: semi_empirical_integrals.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod semi_empirical_store_int_types.mod semi_empirical_int_gks.mod kinds.mod input_constants.mod semi_empirical_int_ana.mod semi_empirical_int_num.mod hfx_compression_methods.mod memory_utilities.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_se_forces.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_se_forces.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod cp_control_types.mod qs_ks_qmmm_types.mod multipole_types.mod kinds.mod qmmm_util.mod message_passing.mod semi_empirical_utils.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_se_forces.F qmmm_se_forces.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:26:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_se_forces.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_se_forces.F90 +/build/reproducible-path/cp2k-8.1/src/qmmm_se_forces.F:209:17: - 229 | ALLOCATE (mixing_store%dfbroy(na, max_shell, nbuffer)) - | ^ -Warning: 'max_shell' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mixing_utils.mod' due to: qs_mixing_utils.o /build/reproducible-path/cp2k-8.1/src/qs_mixing_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cp_para_types.mod pw_types.mod qs_rho_atom_types.mod qs_neighbor_list_types.mod qs_density_mixing_types.mod qs_environment_types.mod cp_control_types.mod distribution_1d_types.mod base_hooks.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod kinds.mod qs_scf_methods.mod + 209 | CPASSERT(iqm == number_qm_atoms) + | ^ +Warning: 'iqm' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_se_forces.mod' due to: qmmm_se_forces.o /build/reproducible-path/cp2k-8.1/src/qmmm_se_forces.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod cp_control_types.mod qs_ks_qmmm_types.mod multipole_types.mod kinds.mod qmmm_util.mod message_passing.mod semi_empirical_utils.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho0_ggrid.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho0_ggrid.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod qs_rho0_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod particle_types.mod qs_local_rho_types.mod pw_pool_types.mod atomic_kind_types.mod qs_force_types.mod pw_methods.mod mathconstants.mod cube_utils.mod util.mod kinds.mod qs_harmonics_atom.mod grid_api.mod qs_integrate_potential.mod gaussian_gridlevels.mod message_passing.mod memory_utilities.mod base_hooks.mod orbital_transformation_matrices.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho0_ggrid.F qs_rho0_ggrid.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:17:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho0_ggrid.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho0_ggrid.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho0_ggrid.mod' due to: qs_rho0_ggrid.o /build/reproducible-path/cp2k-8.1/src/qs_rho0_ggrid.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod qs_rho0_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod particle_types.mod qs_local_rho_types.mod pw_pool_types.mod atomic_kind_types.mod qs_force_types.mod pw_methods.mod mathconstants.mod cube_utils.mod util.mod kinds.mod qs_harmonics_atom.mod grid_api.mod qs_integrate_potential.mod gaussian_gridlevels.mod message_passing.mod memory_utilities.mod base_hooks.mod orbital_transformation_matrices.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pme_tools.o' due to: /build/reproducible-path/cp2k-8.1/src/pme_tools.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod realspace_grid_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pme_tools.F pme_tools.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:26:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pme_tools.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pme_tools.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pme_tools.mod' due to: pme_tools.o /build/reproducible-path/cp2k-8.1/src/pme_tools.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod realspace_grid_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_gapw_densities.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_gapw_densities.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod atomic_kind_types.mod qs_charges_types.mod cp_para_types.mod qs_kind_types.mod qs_rho0_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_rho_atom_methods.mod cp_log_handling.mod message_passing.mod base_hooks.mod qs_rho0_methods.mod kinds.mod qs_rho0_ggrid.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_gapw_densities.F qs_gapw_densities.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:17:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gapw_densities.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gapw_densities.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_gapw_densities.mod' due to: qs_gapw_densities.o /build/reproducible-path/cp2k-8.1/src/qs_gapw_densities.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod atomic_kind_types.mod qs_charges_types.mod cp_para_types.mod qs_kind_types.mod qs_rho0_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_rho_atom_methods.mod cp_log_handling.mod message_passing.mod base_hooks.mod qs_rho0_methods.mod kinds.mod qs_rho0_ggrid.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'spme.o' due to: /build/reproducible-path/cp2k-8.1/src/spme.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod atprop_types.mod atomic_kind_types.mod pw_grid_types.mod ewald_environment_types.mod pw_types.mod ewald_pw_types.mod shell_potential_types.mod realspace_grid_types.mod kinds.mod pw_grids.mod bibliography.mod pw_poisson_methods.mod dgs.mod pw_methods.mod base_hooks.mod mathconstants.mod pme_tools.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/spme.F spme.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:26:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"spme.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' spme.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'spme.mod' due to: spme.o /build/reproducible-path/cp2k-8.1/src/spme.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod atprop_types.mod atomic_kind_types.mod pw_grid_types.mod ewald_environment_types.mod pw_types.mod ewald_pw_types.mod shell_potential_types.mod realspace_grid_types.mod kinds.mod pw_grids.mod bibliography.mod pw_poisson_methods.mod dgs.mod pw_methods.mod base_hooks.mod mathconstants.mod pme_tools.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_vxc.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_vxc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cp_control_types.mod cp_para_types.mod input_section_types.mod pw_types.mod pw_pool_types.mod virial_types.mod pw_env_types.mod cell_types.mod qs_ks_types.mod qs_dispersion_types.mod input_constants.mod pw_methods.mod base_hooks.mod pw_grids.mod xc.mod qs_dispersion_nonloc.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_vxc.F qs_vxc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:17:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_vxc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_vxc.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_vxc.mod' due to: qs_vxc.o /build/reproducible-path/cp2k-8.1/src/qs_vxc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cp_control_types.mod cp_para_types.mod input_section_types.mod pw_types.mod pw_pool_types.mod virial_types.mod pw_env_types.mod cell_types.mod qs_ks_types.mod qs_dispersion_types.mod input_constants.mod pw_methods.mod base_hooks.mod pw_grids.mod xc.mod qs_dispersion_nonloc.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'efield_tb_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/efield_tb_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_period_efield_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod virial_methods.mod message_passing.mod base_hooks.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/efield_tb_methods.F efield_tb_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:27:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"efield_tb_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' efield_tb_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'efield_tb_methods.mod' due to: efield_tb_methods.o /build/reproducible-path/cp2k-8.1/src/efield_tb_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_period_efield_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod virial_methods.mod message_passing.mod base_hooks.mod mathconstants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_vxc_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod qs_kind_types.mod xc_rho_set_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod paw_proj_set_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_linres_types.mod qs_local_rho_types.mod xc_rho_cflags_types.mod atomic_kind_types.mod input_section_types.mod qs_energy_types.mod input_constants.mod util.mod kinds.mod qs_harmonics_atom.mod message_passing.mod xc_derivatives.mod qs_grid_atom.mod xc_atom.mod memory_utilities.mod base_hooks.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F qs_vxc_atom.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:17:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_vxc_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_vxc_atom.F90 -/build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F:318:105: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_cp2k_link.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cp2k_link.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod qs_ks_types.mod cp_control_types.mod qs_kind_types.mod input_section_types.mod input_keyword_types.mod atomic_kind_types.mod ao_util.mod kinds.mod orbital_pointers.mod base_hooks.mod qs_integral_utils.mod string_utilities.mod cp_dbcsr_operations.mod bibliography.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cp2k_link.F cp_dbcsr_cp2k_link.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:27:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_cp2k_link.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_cp2k_link.F90 +/build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cp2k_link.F:509:13: - 318 | ir, rho_nlcc(:, 1), rho_h, rho_s, rho_nlcc(:, 2), drho_h, drho_s) - | ^ -Warning: 'rho_nlcc.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F:113:75: + 509 | IF (jatom /= last_jatom) THEN + | ^ +Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_cp2k_link.mod' due to: cp_dbcsr_cp2k_link.o /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cp2k_link.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod qs_ks_types.mod cp_control_types.mod qs_kind_types.mod input_section_types.mod input_keyword_types.mod atomic_kind_types.mod ao_util.mod kinds.mod orbital_pointers.mod base_hooks.mod qs_integral_utils.mod string_utilities.mod cp_dbcsr_operations.mod bibliography.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atomic_charges.o' due to: /build/reproducible-path/cp2k-8.1/src/atomic_charges.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod particle_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atomic_charges.F atomic_charges.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:27:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atomic_charges.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atomic_charges.F90 +/build/reproducible-path/cp2k-8.1/src/atomic_charges.F:136:30: - 113 | REAL(dp), DIMENSION(:, :), POINTER :: rho_h, rho_nlcc, rho_s, weight - | ^ -Warning: 'rho_nlcc.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F:113:75: Warning: 'rho_nlcc.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F:113:75: Warning: 'rho_nlcc.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_vxc_atom.mod' due to: qs_vxc_atom.o /build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod qs_kind_types.mod xc_rho_set_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod paw_proj_set_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_linres_types.mod qs_local_rho_types.mod xc_rho_cflags_types.mod atomic_kind_types.mod input_section_types.mod qs_energy_types.mod input_constants.mod util.mod kinds.mod qs_harmonics_atom.mod message_passing.mod xc_derivatives.mod qs_grid_atom.mod xc_atom.mod memory_utilities.mod base_hooks.mod orbital_pointers.mod + 136 | SUBROUTINE print_multipoles(particle_set, qs_kind_set, scr, charge, dipole, quadrupole) + | ^ +Warning: 'print_multipoles' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atomic_charges.mod' due to: atomic_charges.o /build/reproducible-path/cp2k-8.1/src/atomic_charges.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod particle_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_contraction.mod' due to: ai_contraction.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mulliken.o' due to: /build/reproducible-path/cp2k-8.1/src/mulliken.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_control_types.mod qs_kind_types.mod particle_types.mod message_passing.mod kinds.mod base_hooks.mod atomic_charges.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mulliken.F mulliken.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:27:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mulliken.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mulliken.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mulliken.mod' due to: mulliken.o /build/reproducible-path/cp2k-8.1/src/mulliken.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_control_types.mod qs_kind_types.mod particle_types.mod message_passing.mod kinds.mod base_hooks.mod atomic_charges.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_overlap.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_overlap.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod virial_types.mod cp_control_types.mod particle_types.mod block_p_types.mod atomic_kind_types.mod qs_force_types.mod qs_ks_types.mod string_utilities.mod kinds.mod virial_methods.mod cp_dbcsr_operations.mod ai_overlap.mod ai_contraction.mod qs_integral_utils.mod cp_dbcsr_cp2k_link.mod orbital_symbols.mod particle_methods.mod base_hooks.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_overlap.F qs_overlap.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:17:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_overlap.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_overlap.F90 -/build/reproducible-path/cp2k-8.1/src/qs_overlap.F:312:46: - - 312 | !$OMP REDUCTION (+ : pv_thread, force_thread ) - | ^ -Warning: 'use_virial' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_overlap.F:312:46: Warning: 'use_cell_mapping' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_overlap.F:522:10: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_output.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_output.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod basis_set_types.mod qs_environment_types.mod qs_kind_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod mathlib.mod message_passing.mod cp_log_handling.mod kinds.mod orbital_pointers.mod base_hooks.mod particle_methods.mod machine.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_output.F cp_dbcsr_output.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:27:26 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_output.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_output.F90 +/build/reproducible-path/cp2k-8.1/src/cp_dbcsr_output.F:245:10: - 522 | IF (dokp) THEN + 245 | IF (print_sym) THEN | ^ -Warning: 'dokp' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_overlap.mod' due to: qs_overlap.o /build/reproducible-path/cp2k-8.1/src/qs_overlap.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod virial_types.mod cp_control_types.mod particle_types.mod block_p_types.mod atomic_kind_types.mod qs_force_types.mod qs_ks_types.mod string_utilities.mod kinds.mod virial_methods.mod cp_dbcsr_operations.mod ai_overlap.mod ai_contraction.mod qs_integral_utils.mod cp_dbcsr_cp2k_link.mod orbital_symbols.mod particle_methods.mod base_hooks.mod orbital_pointers.mod +Warning: 'print_sym' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_output.mod' due to: cp_dbcsr_output.o /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_output.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod basis_set_types.mod qs_environment_types.mod qs_kind_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod mathlib.mod message_passing.mod cp_log_handling.mod kinds.mod orbital_pointers.mod base_hooks.mod particle_methods.mod machine.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_hash_table_functions.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_hash_table_functions.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_hash_table_functions.F qs_hash_table_functions.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:18:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_hash_table_functions.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_hash_table_functions.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_hash_table_functions.mod' due to: qs_hash_table_functions.o /build/reproducible-path/cp2k-8.1/src/qs_hash_table_functions.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewald_methods_tb.o' due to: /build/reproducible-path/cp2k-8.1/src/ewald_methods_tb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod atprop_types.mod qs_neighbor_list_types.mod pw_grid_types.mod ewald_environment_types.mod pw_types.mod virial_types.mod ewald_pw_types.mod realspace_grid_types.mod spme.mod kinds.mod pw_grids.mod virial_methods.mod pw_poisson_methods.mod dgs.mod pw_methods.mod base_hooks.mod mathconstants.mod pme_tools.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewald_methods_tb.F ewald_methods_tb.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:27:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_methods_tb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_methods_tb.F90 +/build/reproducible-path/cp2k-8.1/src/ewald_methods_tb.F:392:58: + + 392 | pfr = -dfr*mcharge(iatom)*mcharge(jatom) + | ^ +Warning: 'dfr' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewald_methods_tb.mod' due to: ewald_methods_tb.o /build/reproducible-path/cp2k-8.1/src/ewald_methods_tb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod atprop_types.mod qs_neighbor_list_types.mod pw_grid_types.mod ewald_environment_types.mod pw_types.mod virial_types.mod ewald_pw_types.mod realspace_grid_types.mod spme.mod kinds.mod pw_grids.mod virial_methods.mod pw_poisson_methods.mod dgs.mod pw_methods.mod base_hooks.mod mathconstants.mod pme_tools.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_nl_hash_table_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_nl_hash_table_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_hash_table_functions.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_nl_hash_table_types.F qs_nl_hash_table_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:18:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_nl_hash_table_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_nl_hash_table_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_nl_hash_table_types.mod' due to: qs_nl_hash_table_types.o /build/reproducible-path/cp2k-8.1/src/qs_nl_hash_table_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_hash_table_functions.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb3_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb3_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod sap_kind_types.mod kpoint_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod atprop_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod distribution_1d_types.mod virial_types.mod qs_energy_types.mod kinds.mod virial_methods.mod message_passing.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dftb3_methods.F qs_dftb3_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:27:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb3_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb3_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb3_methods.mod' due to: qs_dftb3_methods.o /build/reproducible-path/cp2k-8.1/src/qs_dftb3_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod sap_kind_types.mod kpoint_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod atprop_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod distribution_1d_types.mod virial_types.mod qs_energy_types.mod kinds.mod virial_methods.mod message_passing.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod qs_oce_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod sap_kind_types.mod qs_nl_hash_table_types.mod atomic_kind_types.mod qs_force_types.mod util.mod kinds.mod cp_array_utils.mod virial_methods.mod ao_util.mod message_passing.mod qs_oce_methods.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ks_atom.F qs_ks_atom.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:18:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_atom.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_atom.mod' due to: qs_ks_atom.o /build/reproducible-path/cp2k-8.1/src/qs_ks_atom.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod qs_oce_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod sap_kind_types.mod qs_nl_hash_table_types.mod atomic_kind_types.mod qs_force_types.mod util.mod kinds.mod cp_array_utils.mod virial_methods.mod ao_util.mod message_passing.mod qs_oce_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_tb_coulomb.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_tb_coulomb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod pw_poisson_types.mod atprop_types.mod atomic_kind_types.mod qs_environment_types.mod ewald_environment_types.mod distribution_1d_types.mod virial_types.mod ewald_pw_types.mod cp_control_types.mod qs_energy_types.mod ewald_methods_tb.mod kinds.mod message_passing.mod base_hooks.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_tb_coulomb.F qmmm_tb_coulomb.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:27:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_tb_coulomb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_tb_coulomb.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_tb_coulomb.mod' due to: qmmm_tb_coulomb.o /build/reproducible-path/cp2k-8.1/src/qmmm_tb_coulomb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod pw_poisson_types.mod atprop_types.mod atomic_kind_types.mod qs_environment_types.mod ewald_environment_types.mod distribution_1d_types.mod virial_types.mod ewald_pw_types.mod cp_control_types.mod qs_energy_types.mod ewald_methods_tb.mod kinds.mod message_passing.mod base_hooks.mod mathconstants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb_coulomb.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb_coulomb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod sap_kind_types.mod kpoint_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod pw_poisson_types.mod atprop_types.mod qs_dftb_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod distribution_1d_types.mod virial_types.mod ewald_pw_types.mod cp_control_types.mod qs_energy_types.mod ewald_methods_tb.mod kinds.mod qs_dftb3_methods.mod qs_dftb_utils.mod virial_methods.mod message_passing.mod base_hooks.mod qmmm_tb_coulomb.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dftb_coulomb.F qs_dftb_coulomb.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:27:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_coulomb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_coulomb.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb_coulomb.mod' due to: qs_dftb_coulomb.o /build/reproducible-path/cp2k-8.1/src/qs_dftb_coulomb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod sap_kind_types.mod kpoint_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod pw_poisson_types.mod atprop_types.mod qs_dftb_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod distribution_1d_types.mod virial_types.mod ewald_pw_types.mod cp_control_types.mod qs_energy_types.mod ewald_methods_tb.mod kinds.mod qs_dftb3_methods.mod qs_dftb_utils.mod virial_methods.mod message_passing.mod base_hooks.mod qmmm_tb_coulomb.mod mathconstants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb_matrices.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb_matrices.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_mo_types.mod atprop_types.mod qs_dftb_types.mod block_p_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod efield_tb_methods.mod cp_log_handling.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod virial_methods.mod cp_dbcsr_operations.mod message_passing.mod mulliken.mod cp_dbcsr_output.mod particle_methods.mod base_hooks.mod qs_dftb_coulomb.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dftb_matrices.F qs_dftb_matrices.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:27:56 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_matrices.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_matrices.F90 +/build/reproducible-path/cp2k-8.1/src/qs_dftb_matrices.F:419:19: + + 419 | IF (use_virial) THEN + | ^ +Warning: 'use_virial' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb_matrices.mod' due to: qs_dftb_matrices.o /build/reproducible-path/cp2k-8.1/src/qs_dftb_matrices.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_mo_types.mod atprop_types.mod qs_dftb_types.mod block_p_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod efield_tb_methods.mod cp_log_handling.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod virial_methods.mod cp_dbcsr_operations.mod message_passing.mod mulliken.mod cp_dbcsr_output.mod particle_methods.mod base_hooks.mod qs_dftb_coulomb.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_neighbor_lists.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_neighbor_lists.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod qs_dispersion_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod qs_gcp_types.mod qs_dftb_types.mod paw_proj_set_types.mod cp_control_types.mod particle_types.mod qs_environment_types.mod subcell_types.mod almo_scf_types.mod external_potential_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod ewald_environment_types.mod qs_ks_types.mod molecule_types.mod input_constants.mod string_utilities.mod util.mod kinds.mod cp_output_handling.mod physcon.mod qs_dftb_utils.mod message_passing.mod periodic_table.mod cp_log_handling.mod base_hooks.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_neighbor_lists.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_neighbor_lists.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod cell_types.mod almo_scf_types.mod molecule_types.mod qs_dispersion_types.mod qs_dftb_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod external_potential_types.mod qs_kind_types.mod distribution_1d_types.mod qs_gcp_types.mod input_section_types.mod cp_control_types.mod subcell_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod qs_dftb_utils.mod periodic_table.mod message_passing.mod string_utilities.mod util.mod base_hooks.mod input_constants.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_neighbor_lists.F qs_neighbor_lists.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:19:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_neighbor_lists.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_neighbor_lists.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:28:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_neighbor_lists.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_neighbor_lists.F90 /build/reproducible-path/cp2k-8.1/src/qs_neighbor_lists.F:1326:43: 1326 | IF (mol_a /= mol_b) CYCLE @@ -41714,131 +41551,196 @@ 1158 | CPABORT("") | ^ Warning: 'otype' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_neighbor_lists.mod' due to: qs_neighbor_lists.o /build/reproducible-path/cp2k-8.1/src/qs_neighbor_lists.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod qs_dispersion_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod qs_gcp_types.mod qs_dftb_types.mod paw_proj_set_types.mod cp_control_types.mod particle_types.mod qs_environment_types.mod subcell_types.mod almo_scf_types.mod external_potential_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod ewald_environment_types.mod qs_ks_types.mod molecule_types.mod input_constants.mod string_utilities.mod util.mod kinds.mod cp_output_handling.mod physcon.mod qs_dftb_utils.mod message_passing.mod periodic_table.mod cp_log_handling.mod base_hooks.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_neighbor_lists.mod' due to: qs_neighbor_lists.o /build/reproducible-path/cp2k-8.1/src/qs_neighbor_lists.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod cell_types.mod almo_scf_types.mod molecule_types.mod qs_dispersion_types.mod qs_dftb_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod external_potential_types.mod qs_kind_types.mod distribution_1d_types.mod qs_gcp_types.mod input_section_types.mod cp_control_types.mod subcell_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod qs_dftb_utils.mod periodic_table.mod message_passing.mod string_utilities.mod util.mod base_hooks.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'admm_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/admm_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod admm_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod qs_oce_types.mod cp_para_types.mod paw_proj_set_types.mod cp_control_types.mod particle_types.mod qs_environment_types.mod qs_local_rho_types.mod distribution_1d_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod task_list_types.mod qs_ks_types.mod molecule_types.mod qs_energy_types.mod input_constants.mod qs_rho_atom_methods.mod task_list_methods.mod cp_gemm_interface.mod cp_fm_diag.mod qs_gapw_densities.mod qs_vxc.mod qs_vxc_atom.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_oce_methods.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod bibliography.mod cp_fm_cholesky.mod qs_overlap.mod cp_log_handling.mod cp_dbcsr_output.mod qs_ks_atom.mod base_hooks.mod qs_neighbor_lists.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/admm_methods.F admm_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:19:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'admm_methods.mod' due to: admm_methods.o /build/reproducible-path/cp2k-8.1/src/admm_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod admm_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod qs_oce_types.mod cp_para_types.mod paw_proj_set_types.mod cp_control_types.mod particle_types.mod qs_environment_types.mod qs_local_rho_types.mod distribution_1d_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod task_list_types.mod qs_ks_types.mod molecule_types.mod qs_energy_types.mod input_constants.mod qs_rho_atom_methods.mod task_list_methods.mod cp_gemm_interface.mod cp_fm_diag.mod qs_gapw_densities.mod qs_vxc.mod qs_vxc_atom.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_oce_methods.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod bibliography.mod cp_fm_cholesky.mod qs_overlap.mod cp_log_handling.mod cp_dbcsr_output.mod qs_ks_atom.mod base_hooks.mod qs_neighbor_lists.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_contraction.mod' due to: ai_contraction.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_sccs.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_sccs.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod pw_poisson_types.mod pw_pool_types.mod cp_subsys_types.mod qs_scf_types.mod particle_list_types.mod input_section_types.mod qs_energy_types.mod input_constants.mod cp_realspace_grid_init.mod pw_methods.mod mathconstants.mod kinds.mod kahan_sum.mod pw_poisson_methods.mod cp_output_handling.mod rs_methods.mod message_passing.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_sccs.F qs_sccs.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:19:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_sccs.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_sccs.F90 -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:355:38: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_overlap.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_overlap.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod block_p_types.mod atomic_kind_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod kinds.mod cp_dbcsr_cp2k_link.mod ai_overlap.mod virial_methods.mod cp_dbcsr_operations.mod qs_integral_utils.mod string_utilities.mod ai_contraction.mod orbital_pointers.mod particle_methods.mod base_hooks.mod orbital_symbols.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_overlap.F qs_overlap.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:28:24 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_overlap.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_overlap.F90 +/build/reproducible-path/cp2k-8.1/src/qs_overlap.F:312:46: - 355 | filename = mpi_filename - | 1 -Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:440:41: + 312 | !$OMP REDUCTION (+ : pv_thread, force_thread ) + | ^ +Warning: 'use_virial' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_overlap.F:312:46: Warning: 'use_cell_mapping' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_overlap.F:522:10: - 440 | filename = mpi_filename - | 1 -Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:723:38: + 522 | IF (dokp) THEN + | ^ +Warning: 'dokp' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_overlap.mod' due to: qs_overlap.o /build/reproducible-path/cp2k-8.1/src/qs_overlap.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod block_p_types.mod atomic_kind_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod kinds.mod cp_dbcsr_cp2k_link.mod ai_overlap.mod virial_methods.mod cp_dbcsr_operations.mod qs_integral_utils.mod string_utilities.mod ai_contraction.mod orbital_pointers.mod particle_methods.mod base_hooks.mod orbital_symbols.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_tb_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_rho_types.mod pw_poisson_types.mod xtb_types.mod qs_dftb_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod input_section_types.mod ewald_pw_types.mod cp_control_types.mod qs_ks_qmmm_types.mod spme.mod kinds.mod qs_dftb_utils.mod qs_dftb_matrices.mod qmmm_util.mod message_passing.mod cp_dbcsr_operations.mod mulliken.mod qs_neighbor_lists.mod base_hooks.mod qs_overlap.mod input_constants.mod qs_dftb_coulomb.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F qmmm_tb_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:28:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_tb_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_tb_methods.F90 +/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:1395:37: - 723 | filename = mpi_filename - | 1 -Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:787:38: + 1395 | force_ab = -fsr*rij/dr + | ^ +Warning: 'fsr' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:895:13: - 787 | filename = mpi_filename - | 1 -Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:823:38: + 895 | IF (do_dftb) THEN + | ^ +Warning: 'do_dftb' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:897:17: - 823 | filename = mpi_filename - | 1 -Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:1228:81: + 897 | ELSEIF (do_xtb) THEN + | ^ +Warning: 'do_xtb' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:652:13: - 1228 | !$OMP SHARED(ln_rho_max,norm_drho_elec,rho_elec,q,rho_max,rho_min,ub) - | ^ -Warning: 'q' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:1206:73: + 652 | IF (do_dftb) THEN + | ^ +Warning: 'do_dftb' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:654:17: - 1206 | ln_rho_min, q, rho, t, x, y - | ^ -note: 'q' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:1228:81: + 654 | ELSEIF (do_xtb) THEN + | ^ +Warning: 'do_xtb' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:377:10: - 1228 | !$OMP SHARED(ln_rho_max,norm_drho_elec,rho_elec,q,rho_max,rho_min,ub) - | ^ -Warning: 'ln_rho_max' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:1205:92: + 377 | IF (do_dftb) THEN + | ^ +Warning: 'do_dftb' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:379:14: - 1205 | REAL(KIND=dp) :: diff, e, eps_elec, f, ln_rho_max, & - | ^ -note: 'ln_rho_max' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:972:63: + 379 | ELSEIF (do_xtb) THEN + | ^ +Warning: 'do_xtb' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:277:10: - 972 | !$OMP SHARED(ln_rho_max,rho_elec,q,rho_max,rho_min) - | ^ -Warning: 'q' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:951:61: + 277 | IF (do_dftb) THEN + | ^ +Warning: 'do_dftb' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:279:14: - 951 | q, rho, t, x, y - | ^ -note: 'q' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:972:63: + 279 | ELSEIF (do_xtb) THEN + | ^ +Warning: 'do_xtb' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:161:10: - 972 | !$OMP SHARED(ln_rho_max,rho_elec,q,rho_max,rho_min) - | ^ -Warning: 'ln_rho_max' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:950:87: + 161 | IF (do_dftb) THEN + | ^ +Warning: 'do_dftb' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:163:14: - 950 | REAL(KIND=dp) :: diff, dq, dt, f, ln_rho_max, ln_rho_min, & - | ^ -note: 'ln_rho_max' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:972:63: + 163 | ELSEIF (do_xtb) THEN + | ^ +Warning: 'do_xtb' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_tb_methods.mod' due to: qmmm_tb_methods.o /build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_rho_types.mod pw_poisson_types.mod xtb_types.mod qs_dftb_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod input_section_types.mod ewald_pw_types.mod cp_control_types.mod qs_ks_qmmm_types.mod spme.mod kinds.mod qs_dftb_utils.mod qs_dftb_matrices.mod qmmm_util.mod message_passing.mod cp_dbcsr_operations.mod mulliken.mod qs_neighbor_lists.mod base_hooks.mod qs_overlap.mod input_constants.mod qs_dftb_coulomb.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mm_collocate_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/mm_collocate_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod cube_utils.mod ao_util.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mm_collocate_potential.F mm_collocate_potential.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:28:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mm_collocate_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mm_collocate_potential.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mm_collocate_potential.mod' due to: mm_collocate_potential.o /build/reproducible-path/cp2k-8.1/src/mm_collocate_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod cube_utils.mod ao_util.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_se_energy.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_se_energy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod qmmm_types_low.mod qs_ks_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_control_types.mod qs_energy_types.mod multipole_types.mod qs_ks_qmmm_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qmmm_util.mod cp_dbcsr_operations.mod message_passing.mod qs_neighbor_lists.mod cp_dbcsr_output.mod semi_empirical_utils.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod base_hooks.mod qs_overlap.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_se_energy.F qmmm_se_energy.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:28:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_se_energy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_se_energy.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_se_energy.mod' due to: qmmm_se_energy.o /build/reproducible-path/cp2k-8.1/src/qmmm_se_energy.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod qmmm_types_low.mod qs_ks_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_control_types.mod qs_energy_types.mod multipole_types.mod qs_ks_qmmm_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qmmm_util.mod cp_dbcsr_operations.mod message_passing.mod qs_neighbor_lists.mod cp_dbcsr_output.mod semi_empirical_utils.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod base_hooks.mod qs_overlap.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'realspace_grid_cube.mod' due to: realspace_grid_cube.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_realspace_grid_cube.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_realspace_grid_cube.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_list_types.mod pw_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod cp_output_handling.mod realspace_grid_cube.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_realspace_grid_cube.F cp_realspace_grid_cube.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:28:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_realspace_grid_cube.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_realspace_grid_cube.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_realspace_grid_cube.mod' due to: cp_realspace_grid_cube.o /build/reproducible-path/cp2k-8.1/src/cp_realspace_grid_cube.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_list_types.mod pw_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod cp_output_handling.mod realspace_grid_cube.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_gpw_energy.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_gpw_energy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod pw_pool_types.mod particle_types.mod cell_types.mod particle_list_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod qs_ks_qmmm_types.mod qmmm_gaussian_types.mod cp_log_handling.mod kinds.mod qmmm_se_energy.mod cp_output_handling.mod qmmm_util.mod qmmm_tb_methods.mod cube_utils.mod message_passing.mod cp_realspace_grid_cube.mod cp_spline_utils.mod mm_collocate_potential.mod pw_methods.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_gpw_energy.F qmmm_gpw_energy.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:29:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gpw_energy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gpw_energy.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_gpw_energy.mod' due to: qmmm_gpw_energy.o /build/reproducible-path/cp2k-8.1/src/qmmm_gpw_energy.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod pw_pool_types.mod particle_types.mod cell_types.mod particle_list_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod qs_ks_qmmm_types.mod qmmm_gaussian_types.mod cp_log_handling.mod kinds.mod qmmm_se_energy.mod cp_output_handling.mod qmmm_util.mod qmmm_tb_methods.mod cube_utils.mod message_passing.mod cp_realspace_grid_cube.mod cp_spline_utils.mod mm_collocate_potential.mod pw_methods.mod base_hooks.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_gpw_forces.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod qs_ks_qmmm_types.mod qmmm_gaussian_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qmmm_se_forces.mod qmmm_util.mod qmmm_tb_methods.mod cube_utils.mod message_passing.mod cp_spline_utils.mod mm_collocate_potential.mod pw_methods.mod base_hooks.mod input_constants.mod qmmm_gpw_energy.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F qmmm_gpw_forces.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:29:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gpw_forces.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gpw_forces.F90 +/build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F:484:36: - 972 | !$OMP SHARED(ln_rho_max,rho_elec,q,rho_max,rho_min) - | ^ -Warning: 'dq' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:950:68: + 484 | tmp = rho%cr3d(lb(1), :, :) + | ^ +Warning: 'tmp.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F:484:36: Warning: 'tmp.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F:484:36: Warning: 'tmp.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F:484:36: - 950 | REAL(KIND=dp) :: diff, dq, dt, f, ln_rho_max, ln_rho_min, & - | ^ -note: 'dq' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_sccs.mod' due to: qs_sccs.o /build/reproducible-path/cp2k-8.1/src/qs_sccs.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod pw_poisson_types.mod pw_pool_types.mod cp_subsys_types.mod qs_scf_types.mod particle_list_types.mod input_section_types.mod qs_energy_types.mod input_constants.mod cp_realspace_grid_init.mod pw_methods.mod mathconstants.mod kinds.mod kahan_sum.mod pw_poisson_methods.mod cp_output_handling.mod rs_methods.mod message_passing.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod cp_units.mod + 484 | tmp = rho%cr3d(lb(1), :, :) + | ^ +Warning: 'tmp.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_gpw_forces.mod' due to: qmmm_gpw_forces.o /build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod qs_ks_qmmm_types.mod qmmm_gaussian_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qmmm_se_forces.mod qmmm_util.mod qmmm_tb_methods.mod cube_utils.mod message_passing.mod cp_spline_utils.mod mm_collocate_potential.mod pw_methods.mod base_hooks.mod input_constants.mod qmmm_gpw_energy.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_qmmm_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_qmmm_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ks_qmmm_types.mod input_section_types.mod pw_pool_types.mod pw_types.mod qmmm_types_low.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod input_constants.mod pw_methods.mod cp_log_handling.mod base_hooks.mod d3_poly.mod cp_output_handling.mod cube_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ks_qmmm_methods.F qs_ks_qmmm_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:19:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_qmmm_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_qmmm_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_qmmm_methods.mod' due to: qs_ks_qmmm_methods.o /build/reproducible-path/cp2k-8.1/src/qs_ks_qmmm_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ks_qmmm_types.mod input_section_types.mod pw_pool_types.mod pw_types.mod qmmm_types_low.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod input_constants.mod pw_methods.mod cp_log_handling.mod base_hooks.mod d3_poly.mod cp_output_handling.mod cube_utils.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dos.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dos.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod kpoint_types.mod cp_control_types.mod qs_mo_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_output_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dos.F qs_dos.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:29:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dos.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dos.F90 +/build/reproducible-path/cp2k-8.1/src/qs_dos.F:139:28: + + 139 | nhist = MAXVAL(nmo) + | ^ +Warning: 'nmo[0]' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dos.F:139:28: Warning: 'nmo[1]' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dos.mod' due to: qs_dos.o /build/reproducible-path/cp2k-8.1/src/qs_dos.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod kpoint_types.mod cp_control_types.mod qs_mo_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_output_handling.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atomic_charges.o' due to: /build/reproducible-path/cp2k-8.1/src/atomic_charges.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod qs_kind_types.mod particle_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atomic_charges.F atomic_charges.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:19:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atomic_charges.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atomic_charges.F90 -/build/reproducible-path/cp2k-8.1/src/atomic_charges.F:136:30: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_cholesky.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cholesky.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod kinds.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cholesky.F cp_dbcsr_cholesky.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:29:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_cholesky.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_cholesky.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_cholesky.mod' due to: cp_dbcsr_cholesky.o /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cholesky.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod kinds.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'admm_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/admm_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod kinds.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/admm_utils.F admm_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:29:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'admm_utils.mod' due to: admm_utils.o /build/reproducible-path/cp2k-8.1/src/admm_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod kinds.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod cp_dbcsr_operations.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fermi_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/fermi_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kahan_sum.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fermi_utils.F fermi_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:29:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fermi_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fermi_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fermi_utils.mod' due to: fermi_utils.o /build/reproducible-path/cp2k-8.1/src/fermi_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kahan_sum.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mo_occupation.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mo_occupation.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xas_env_types.mod scf_control_types.mod qs_mo_types.mod util.mod kahan_sum.mod cp_log_handling.mod kinds.mod fermi_utils.mod input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_mo_occupation.F qs_mo_occupation.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:29:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mo_occupation.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mo_occupation.F90 +/build/reproducible-path/cp2k-8.1/src/qs_mo_occupation.F:157:26: - 136 | SUBROUTINE print_multipoles(particle_set, qs_kind_set, scr, charge, dipole, quadrupole) - | ^ -Warning: 'print_multipoles' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atomic_charges.mod' due to: atomic_charges.o /build/reproducible-path/cp2k-8.1/src/atomic_charges.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod qs_kind_types.mod particle_types.mod base_hooks.mod kinds.mod + 157 | homo_a = lfomo_a - 1 + | ^ +Warning: 'lfomo_a' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_occupation.F:164:26: + + 164 | homo_b = lfomo_b - 1 + | ^ +Warning: 'lfomo_b' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mo_occupation.mod' due to: qs_mo_occupation.o /build/reproducible-path/cp2k-8.1/src/qs_mo_occupation.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xas_env_types.mod scf_control_types.mod qs_mo_types.mod util.mod kahan_sum.mod cp_log_handling.mod kinds.mod fermi_utils.mod input_constants.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mulliken.o' due to: /build/reproducible-path/cp2k-8.1/src/mulliken.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_kind_types.mod cp_control_types.mod particle_types.mod base_hooks.mod message_passing.mod atomic_charges.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mulliken.F mulliken.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:19:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mulliken.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mulliken.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mulliken.mod' due to: mulliken.o /build/reproducible-path/cp2k-8.1/src/mulliken.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_kind_types.mod cp_control_types.mod particle_types.mod base_hooks.mod message_passing.mod atomic_charges.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_cfm_diag.mod' due to: cp_cfm_diag.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_charge_mixing.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_charge_mixing.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_density_mixing_types.mod mathlib.mod base_hooks.mod message_passing.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_charge_mixing.F qs_charge_mixing.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:19:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_charge_mixing.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_charge_mixing.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_charge_mixing.mod' due to: qs_charge_mixing.o /build/reproducible-path/cp2k-8.1/src/qs_charge_mixing.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_density_mixing_types.mod mathlib.mod base_hooks.mod message_passing.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_diag.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_diag.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_cfm_types.mod cp_fm_types.mod kinds.mod cp_fm_diag.mod base_hooks.mod cp_cfm_diag.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_diag.F cp_dbcsr_diag.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:29:29 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_diag.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_diag.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_diag.mod' due to: cp_dbcsr_diag.o /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_diag.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_cfm_types.mod cp_fm_types.mod kinds.mod cp_fm_diag.mod base_hooks.mod cp_cfm_diag.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mo_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mo_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod scf_control_types.mod qs_mo_types.mod admm_types.mod cp_fm_types.mod admm_utils.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_fm_struct.mod qs_mo_occupation.mod cp_dbcsr_operations.mod message_passing.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod cp_dbcsr_diag.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_mo_methods.F qs_mo_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:29:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mo_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mo_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mo_methods.mod' due to: qs_mo_methods.o /build/reproducible-path/cp2k-8.1/src/qs_mo_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod scf_control_types.mod qs_mo_types.mod admm_types.mod cp_fm_types.mod admm_utils.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_fm_struct.mod qs_mo_occupation.mod cp_dbcsr_operations.mod message_passing.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod cp_dbcsr_diag.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'submatrix_types.o' due to: /build/reproducible-path/cp2k-8.1/src/submatrix_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/submatrix_types.F submatrix_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:29:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"submatrix_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' submatrix_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'submatrix_types.mod' due to: submatrix_types.o /build/reproducible-path/cp2k-8.1/src/submatrix_types.F util.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'submatrix_dissection.o' due to: /build/reproducible-path/cp2k-8.1/src/submatrix_dissection.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 submatrix_types.mod message_passing.mod kinds.mod base_hooks.mod bibliography.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/submatrix_dissection.F submatrix_dissection.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:29:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"submatrix_dissection.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' submatrix_dissection.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'submatrix_dissection.mod' due to: submatrix_dissection.o /build/reproducible-path/cp2k-8.1/src/submatrix_dissection.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 submatrix_types.mod message_passing.mod kinds.mod base_hooks.mod bibliography.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'arnoldi_types.o' due to: /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_types.F arnoldi_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:19:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/arnoldi/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:29:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/arnoldi/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_types.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'arnoldi_types.mod' due to: arnoldi_types.o /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_types.F kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'arnoldi_geev.o' due to: /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_geev.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_geev.F arnoldi_geev.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:20:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_geev.F\"" -I'/build/reproducible-path/cp2k-8.1/src/arnoldi/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_geev.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'arnoldi_geev.mod' due to: arnoldi_geev.o /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_geev.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dbcsr_vector.o' due to: /build/reproducible-path/cp2k-8.1/src/dbcsrx/dbcsr_vector.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/dbcsrx/hash_table_types.f90 /build/reproducible-path/cp2k-8.1/src/dbcsrx/hash_table.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dbcsr_vector.o' due to: /build/reproducible-path/cp2k-8.1/src/dbcsrx/dbcsr_vector.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/dbcsrx/hash_table_types.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/dbcsrx/hash_table.f90 message_passing.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dbcsrx/dbcsr_vector.F dbcsr_vector.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:20:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dbcsrx/dbcsr_vector.F\"" -I'/build/reproducible-path/cp2k-8.1/src/dbcsrx/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dbcsr_vector.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:29:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dbcsrx/dbcsr_vector.F\"" -I'/build/reproducible-path/cp2k-8.1/src/dbcsrx/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dbcsr_vector.F90 /build/reproducible-path/cp2k-8.1/src/dbcsrx/dbcsr_vector.F:503:41: 503 | SUBROUTINE dbcsr_matrixT_vector_mult_${nametype}$ (matrix, vec_in, vec_out, alpha, beta, work_row, work_col, skip_diag) @@ -41859,16 +41761,21 @@ 503 | SUBROUTINE dbcsr_matrixT_vector_mult_${nametype}$ (matrix, vec_in, vec_out, alpha, beta, work_row, work_col, skip_diag) | ^ Warning: 'dbcsr_matrixt_vector_mult_z' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dbcsr_vector.mod' due to: dbcsr_vector.o /build/reproducible-path/cp2k-8.1/src/dbcsrx/dbcsr_vector.F /build/reproducible-path/cp2k-8.1/src/dbcsrx/hash_table_types.f90 /build/reproducible-path/cp2k-8.1/src/dbcsrx/hash_table.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 message_passing.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dbcsr_vector.mod' due to: dbcsr_vector.o /build/reproducible-path/cp2k-8.1/src/dbcsrx/dbcsr_vector.F /build/reproducible-path/cp2k-8.1/src/dbcsrx/hash_table_types.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/dbcsrx/hash_table.f90 message_passing.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'arnoldi_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi.fypp arnoldi_types.mod arnoldi_geev.mod base_hooks.mod message_passing.mod dbcsr_vector.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'arnoldi_geev.o' due to: /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_geev.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_geev.F arnoldi_geev.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:30:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_geev.F\"" -I'/build/reproducible-path/cp2k-8.1/src/arnoldi/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_geev.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'arnoldi_geev.mod' due to: arnoldi_geev.o /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_geev.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'arnoldi_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi.fypp arnoldi_types.mod dbcsr_vector.mod message_passing.mod kinds.mod base_hooks.mod arnoldi_geev.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_methods.F arnoldi_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:20:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/arnoldi/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'arnoldi_methods.mod' due to: arnoldi_methods.o /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi.fypp arnoldi_types.mod arnoldi_geev.mod base_hooks.mod message_passing.mod dbcsr_vector.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:30:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/arnoldi/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'arnoldi_methods.mod' due to: arnoldi_methods.o /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi.fypp arnoldi_types.mod dbcsr_vector.mod message_passing.mod kinds.mod base_hooks.mod arnoldi_geev.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'arnoldi_data_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_selection.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi.fypp /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_manipulation.f90 arnoldi_types.mod base_hooks.mod dbcsr_vector.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'arnoldi_data_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_selection.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi.fypp /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_manipulation.f90 arnoldi_types.mod dbcsr_vector.mod util.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F arnoldi_data_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:21:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_data_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/arnoldi/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_data_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:30:56 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_data_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/arnoldi/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_data_methods.F90 /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F:226:32: 226 | SUBROUTINE set_eval_selection(ar_data, itype) @@ -41889,11 +41796,11 @@ 307 | FUNCTION get_selected_ritz_val(ar_data, ind) RESULT(eval_out) | ^ note: 'eval_out' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'arnoldi_data_methods.mod' due to: arnoldi_data_methods.o /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_selection.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi.fypp /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_manipulation.f90 arnoldi_types.mod base_hooks.mod dbcsr_vector.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'arnoldi_data_methods.mod' due to: arnoldi_data_methods.o /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_methods.F /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_selection.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi.fypp /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_data_manipulation.f90 arnoldi_types.mod dbcsr_vector.mod util.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'arnoldi_api.o' due to: /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_api.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 arnoldi_types.mod base_hooks.mod arnoldi_methods.mod arnoldi_data_methods.mod message_passing.mod dbcsr_vector.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'arnoldi_api.o' due to: /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_api.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 arnoldi_types.mod dbcsr_vector.mod arnoldi_methods.mod message_passing.mod arnoldi_data_methods.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_api.F arnoldi_api.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:21:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_api.F\"" -I'/build/reproducible-path/cp2k-8.1/src/arnoldi/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_api.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:31:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_api.F\"" -I'/build/reproducible-path/cp2k-8.1/src/arnoldi/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' arnoldi_api.F90 /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_api.F:493:13: 493 | IF (SQRT(rsnew) < control%threshold) control%converged = .TRUE. @@ -41904,173 +41811,543 @@ 399 | REAL(KIND=dp) :: alpha, beta, pap, rsnew, rsold | ^ note: 'rsnew' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'arnoldi_api.mod' due to: arnoldi_api.o /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_api.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 arnoldi_types.mod base_hooks.mod arnoldi_methods.mod arnoldi_data_methods.mod message_passing.mod dbcsr_vector.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'arnoldi_api.mod' due to: arnoldi_api.o /build/reproducible-path/cp2k-8.1/src/arnoldi/arnoldi_api.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 arnoldi_types.mod dbcsr_vector.mod arnoldi_methods.mod message_passing.mod arnoldi_data_methods.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_condnum.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_condnum.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod arnoldi_api.mod mathlib.mod base_hooks.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_condnum.F qs_condnum.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:21:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_condnum.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_condnum.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_condnum.mod' due to: qs_condnum.o /build/reproducible-path/cp2k-8.1/src/qs_condnum.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod arnoldi_api.mod mathlib.mod base_hooks.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'iterate_matrix.o' due to: /build/reproducible-path/cp2k-8.1/src/iterate_matrix.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathlib.mod message_passing.mod submatrix_dissection.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod machine.mod input_constants.mod arnoldi_api.mod bibliography.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/iterate_matrix.F iterate_matrix.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:31:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"iterate_matrix.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' iterate_matrix.F90 +/build/reproducible-path/cp2k-8.1/src/iterate_matrix.F:2128:32: + + 2128 | SUBROUTINE matrix_exponential(matrix_exp, matrix, omega, alpha, threshold) + | ^ +Warning: 'matrix_exponential' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'iterate_matrix.mod' due to: iterate_matrix.o /build/reproducible-path/cp2k-8.1/src/iterate_matrix.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathlib.mod message_passing.mod submatrix_dissection.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod machine.mod input_constants.mod arnoldi_api.mod bibliography.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'efield_tb_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/efield_tb_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod qs_period_efield_types.mod kpoint_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod cp_control_types.mod qs_environment_types.mod particle_types.mod atomic_kind_types.mod qs_force_types.mod qs_energy_types.mod mathconstants.mod kinds.mod virial_methods.mod message_passing.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/efield_tb_methods.F efield_tb_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:21:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"efield_tb_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' efield_tb_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'efield_tb_methods.mod' due to: efield_tb_methods.o /build/reproducible-path/cp2k-8.1/src/efield_tb_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod qs_period_efield_types.mod kpoint_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod cp_control_types.mod qs_environment_types.mod particle_types.mod atomic_kind_types.mod qs_force_types.mod qs_energy_types.mod mathconstants.mod kinds.mod virial_methods.mod message_passing.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'preconditioner_solvers.o' due to: /build/reproducible-path/cp2k-8.1/src/preconditioner_solvers.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod cp_fm_types.mod kinds.mod iterate_matrix.mod base_hooks.mod input_constants.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod arnoldi_api.mod cp_fm_basic_linalg.mod bibliography.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/preconditioner_solvers.F preconditioner_solvers.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:31:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner_solvers.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner_solvers.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'preconditioner_solvers.mod' due to: preconditioner_solvers.o /build/reproducible-path/cp2k-8.1/src/preconditioner_solvers.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod cp_fm_types.mod kinds.mod iterate_matrix.mod base_hooks.mod input_constants.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_fm_struct.mod arnoldi_api.mod cp_fm_basic_linalg.mod bibliography.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pme_tools.o' due to: /build/reproducible-path/cp2k-8.1/src/pme_tools.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod atomic_kind_types.mod cell_types.mod particle_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pme_tools.F pme_tools.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:21:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pme_tools.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pme_tools.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pme_tools.mod' due to: pme_tools.o /build/reproducible-path/cp2k-8.1/src/pme_tools.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod atomic_kind_types.mod cell_types.mod particle_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'preconditioner_apply.o' due to: /build/reproducible-path/cp2k-8.1/src/preconditioner_apply.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod cp_fm_types.mod kinds.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod cp_fm_cholesky.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/preconditioner_apply.F preconditioner_apply.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:31:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner_apply.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner_apply.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'preconditioner_apply.mod' due to: preconditioner_apply.o /build/reproducible-path/cp2k-8.1/src/preconditioner_apply.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod cp_fm_types.mod kinds.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod cp_fm_cholesky.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'spme.o' due to: /build/reproducible-path/cp2k-8.1/src/spme.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod shell_potential_types.mod pw_types.mod cell_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod atprop_types.mod atomic_kind_types.mod ewald_pw_types.mod ewald_environment_types.mod pw_grid_types.mod pw_methods.mod mathconstants.mod pw_grids.mod kinds.mod pw_poisson_methods.mod pme_tools.mod dgs.mod bibliography.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/spme.F spme.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:21:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"spme.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' spme.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'spme.mod' due to: spme.o /build/reproducible-path/cp2k-8.1/src/spme.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod shell_potential_types.mod pw_types.mod cell_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod atprop_types.mod atomic_kind_types.mod ewald_pw_types.mod ewald_environment_types.mod pw_grid_types.mod pw_methods.mod mathconstants.mod pw_grids.mod kinds.mod pw_poisson_methods.mod pme_tools.mod dgs.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'preconditioner_makes.o' due to: /build/reproducible-path/cp2k-8.1/src/preconditioner_makes.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod cp_fm_types.mod kinds.mod cp_fm_diag.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod cp_fm_cholesky.mod cp_fm_struct.mod arnoldi_api.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/preconditioner_makes.F preconditioner_makes.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:31:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner_makes.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner_makes.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'preconditioner_makes.mod' due to: preconditioner_makes.o /build/reproducible-path/cp2k-8.1/src/preconditioner_makes.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod cp_fm_types.mod kinds.mod cp_fm_diag.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod cp_fm_cholesky.mod cp_fm_struct.mod arnoldi_api.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewald_methods_tb.o' due to: /build/reproducible-path/cp2k-8.1/src/ewald_methods_tb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod cp_para_types.mod virial_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod atprop_types.mod ewald_pw_types.mod ewald_environment_types.mod pw_grid_types.mod pw_methods.mod mathconstants.mod pw_grids.mod kinds.mod pw_poisson_methods.mod pme_tools.mod virial_methods.mod spme.mod dgs.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewald_methods_tb.F ewald_methods_tb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:21:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_methods_tb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_methods_tb.F90 -/build/reproducible-path/cp2k-8.1/src/ewald_methods_tb.F:392:58: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'preconditioner.o' due to: /build/reproducible-path/cp2k-8.1/src/preconditioner.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod preconditioner_types.mod cp_control_types.mod cp_fm_types.mod qs_mo_types.mod kinds.mod qs_mo_methods.mod base_hooks.mod input_constants.mod cp_blacs_env.mod preconditioner_solvers.mod preconditioner_apply.mod preconditioner_makes.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/preconditioner.F preconditioner.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:31:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'preconditioner.mod' due to: preconditioner.o /build/reproducible-path/cp2k-8.1/src/preconditioner.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod preconditioner_types.mod cp_control_types.mod cp_fm_types.mod qs_mo_types.mod kinds.mod qs_mo_methods.mod base_hooks.mod input_constants.mod cp_blacs_env.mod preconditioner_solvers.mod preconditioner_apply.mod preconditioner_makes.mod cp_dbcsr_operations.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ot.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ot.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod qs_ot_types.mod message_passing.mod cp_dbcsr_cholesky.mod preconditioner.mod kinds.mod base_hooks.mod arnoldi_api.mod cp_dbcsr_diag.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ot.F qs_ot.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:31:24 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ot.mod' due to: qs_ot.o /build/reproducible-path/cp2k-8.1/src/qs_ot.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod qs_ot_types.mod message_passing.mod cp_dbcsr_cholesky.mod preconditioner.mod kinds.mod base_hooks.mod arnoldi_api.mod cp_dbcsr_diag.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ot_minimizer.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ot_minimizer.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod mathlib.mod qs_ot.mod cp_log_handling.mod kinds.mod base_hooks.mod preconditioner.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ot_minimizer.F qs_ot_minimizer.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:31:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot_minimizer.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot_minimizer.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ot_minimizer.mod' due to: qs_ot_minimizer.o /build/reproducible-path/cp2k-8.1/src/qs_ot_minimizer.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod mathlib.mod qs_ot.mod cp_log_handling.mod kinds.mod base_hooks.mod preconditioner.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ot_eigensolver.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ot_eigensolver.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod qs_ot_types.mod cp_fm_types.mod qs_ot.mod cp_dbcsr_cholesky.mod cp_log_handling.mod kinds.mod qs_mo_methods.mod base_hooks.mod cp_dbcsr_operations.mod qs_ot_minimizer.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ot_eigensolver.F qs_ot_eigensolver.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:31:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot_eigensolver.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot_eigensolver.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ot_eigensolver.mod' due to: qs_ot_eigensolver.o /build/reproducible-path/cp2k-8.1/src/qs_ot_eigensolver.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod qs_ot_types.mod cp_fm_types.mod qs_ot.mod cp_dbcsr_cholesky.mod cp_log_handling.mod kinds.mod qs_mo_methods.mod base_hooks.mod cp_dbcsr_operations.mod qs_ot_minimizer.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'population_analyses.o' due to: /build/reproducible-path/cp2k-8.1/src/population_analyses.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod scf_control_types.mod particle_types.mod qs_rho_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_dbcsr_output.mod orbital_pointers.mod particle_methods.mod cp_blacs_env.mod machine.mod base_hooks.mod cp_fm_diag.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/population_analyses.F population_analyses.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:31:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"population_analyses.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' population_analyses.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'population_analyses.mod' due to: population_analyses.o /build/reproducible-path/cp2k-8.1/src/population_analyses.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod scf_control_types.mod particle_types.mod qs_rho_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_dbcsr_output.mod orbital_pointers.mod particle_methods.mod cp_blacs_env.mod machine.mod base_hooks.mod cp_fm_diag.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'task_list_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/task_list_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/array_sort.fypp kpoint_types.mod qs_ks_types.mod particle_types.mod cell_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod task_list_types.mod realspace_grid_types.mod kinds.mod cube_utils.mod message_passing.mod memory_utilities.mod util.mod particle_methods.mod base_hooks.mod gaussian_gridlevels.mod ao_util.mod grid_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/task_list_methods.F task_list_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:31:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"task_list_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' task_list_methods.F90 +/build/reproducible-path/cp2k-8.1/src/task_list_methods.F:1015:66: - 392 | pfr = -dfr*mcharge(iatom)*mcharge(jatom) + 1015 | ilocal, k, maxdest, Ncpu, Nflux + | ^ +Warning: 'ilocal' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/task_list_methods.F:402:46: + + 402 | task_list%npairs(igrid_level) = ipair + | ^ +Warning: 'igrid_level' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'task_list_methods.mod' due to: task_list_methods.o /build/reproducible-path/cp2k-8.1/src/task_list_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/common/array_sort.fypp kpoint_types.mod qs_ks_types.mod particle_types.mod cell_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod qs_kind_types.mod cp_control_types.mod task_list_types.mod realspace_grid_types.mod kinds.mod cube_utils.mod message_passing.mod memory_utilities.mod util.mod particle_methods.mod base_hooks.mod gaussian_gridlevels.mod ao_util.mod grid_api.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rs_pw_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/pw_env/rs_pw_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_env_types.mod pw_pool_types.mod pw_types.mod input_section_types.mod realspace_grid_types.mod gaussian_gridlevels.mod cp_log_handling.mod kinds.mod pw_methods.mod cp_spline_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw_env/rs_pw_interface.F rs_pw_interface.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:32:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env/rs_pw_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/pw_env/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rs_pw_interface.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rs_pw_interface.mod' due to: rs_pw_interface.o /build/reproducible-path/cp2k-8.1/src/pw_env/rs_pw_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_env_types.mod pw_pool_types.mod pw_types.mod input_section_types.mod realspace_grid_types.mod gaussian_gridlevels.mod cp_log_handling.mod kinds.mod pw_methods.mod cp_spline_utils.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_collocate_density.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_collocate_density.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod external_potential_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod task_list_types.mod lri_environment_types.mod realspace_grid_types.mod kinds.mod cp_dbcsr_operations.mod cube_utils.mod task_list_methods.mod memory_utilities.mod orbital_pointers.mod pw_methods.mod rs_pw_interface.mod base_hooks.mod gaussian_gridlevels.mod ao_util.mod input_constants.mod grid_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_collocate_density.F qs_collocate_density.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:32:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_collocate_density.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_collocate_density.F90 +/build/reproducible-path/cp2k-8.1/src/qs_collocate_density.F:1926:10: + + 1926 | IF (distributed_rs_grids) THEN + | ^ +Warning: 'distributed_rs_grids' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_collocate_density.mod' due to: qs_collocate_density.o /build/reproducible-path/cp2k-8.1/src/qs_collocate_density.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod external_potential_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod task_list_types.mod lri_environment_types.mod realspace_grid_types.mod kinds.mod cp_dbcsr_operations.mod cube_utils.mod task_list_methods.mod memory_utilities.mod orbital_pointers.mod pw_methods.mod rs_pw_interface.mod base_hooks.mod gaussian_gridlevels.mod ao_util.mod input_constants.mod grid_api.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_energy_window.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_energy_window.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qs_ks_types.mod qs_rho_types.mod particle_list_types.mod cp_fm_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod qs_subsys_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_realspace_grid_cube.mod qs_collocate_density.mod cp_fm_basic_linalg.mod iterate_matrix.mod pw_methods.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_energy_window.F qs_energy_window.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:32:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_window.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_window.F90 +/build/reproducible-path/cp2k-8.1/src/qs_energy_window.F:142:15: + + 142 | stride = section_get_ivals(dft_section, "PRINT%ENERGY_WINDOWS%STRIDE") + | 1 +Warning: POINTER-valued function appears on right-hand side of assignment at (1) [-Wsurprising] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_energy_window.mod' due to: qs_energy_window.o /build/reproducible-path/cp2k-8.1/src/qs_energy_window.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qs_ks_types.mod qs_rho_types.mod particle_list_types.mod cp_fm_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod qs_subsys_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_realspace_grid_cube.mod qs_collocate_density.mod cp_fm_basic_linalg.mod iterate_matrix.mod pw_methods.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_oce_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_oce_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 paw_proj_set_types.mod basis_set_types.mod qs_neighbor_list_types.mod sap_kind_types.mod qs_kind_types.mod particle_types.mod block_p_types.mod ao_util.mod mathconstants.mod kinds.mod orbital_pointers.mod orbital_transformation_matrices.mod ai_overlap.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_oce_methods.F qs_oce_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:32:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_oce_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_oce_methods.F90 +/build/reproducible-path/cp2k-8.1/src/qs_oce_methods.F:84:58: + + 84 | maxder, maxlb, maxlprj, maxnprja, maxsoa, msab, n, ncob, np_car, np_sph, nsatbas, nseta, & | ^ -Warning: 'dfr' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewald_methods_tb.mod' due to: ewald_methods_tb.o /build/reproducible-path/cp2k-8.1/src/ewald_methods_tb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod cp_para_types.mod virial_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod atprop_types.mod ewald_pw_types.mod ewald_environment_types.mod pw_grid_types.mod pw_methods.mod mathconstants.mod pw_grids.mod kinds.mod pw_poisson_methods.mod pme_tools.mod virial_methods.mod spme.mod dgs.mod base_hooks.mod +Warning: 'n' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_oce_methods.F:548:40: + + 548 | clist%nsgf_cnt = nsgf_cnt + | ^ +Warning: 'nsgf_cnt' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_oce_methods.mod' due to: qs_oce_methods.o /build/reproducible-path/cp2k-8.1/src/qs_oce_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 paw_proj_set_types.mod basis_set_types.mod qs_neighbor_list_types.mod sap_kind_types.mod qs_kind_types.mod particle_types.mod block_p_types.mod ao_util.mod mathconstants.mod kinds.mod orbital_pointers.mod orbital_transformation_matrices.mod ai_overlap.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb3_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb3_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod particle_types.mod atprop_types.mod sap_kind_types.mod distribution_1d_types.mod atomic_kind_types.mod qs_force_types.mod qs_energy_types.mod kinds.mod virial_methods.mod message_passing.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dftb3_methods.F qs_dftb3_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:21:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb3_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb3_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb3_methods.mod' due to: qs_dftb3_methods.o /build/reproducible-path/cp2k-8.1/src/qs_dftb3_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod particle_types.mod atprop_types.mod sap_kind_types.mod distribution_1d_types.mod atomic_kind_types.mod qs_force_types.mod qs_energy_types.mod kinds.mod virial_methods.mod message_passing.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho_atom_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho_atom_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod sap_kind_types.mod kpoint_types.mod qs_oce_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_control_types.mod qs_rho_atom_types.mod kinds.mod spherical_harmonics.mod qs_harmonics_atom.mod message_passing.mod whittaker.mod qs_grid_atom.mod memory_utilities.mod util.mod orbital_pointers.mod lebedev.mod base_hooks.mod qs_oce_methods.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho_atom_methods.F qs_rho_atom_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:32:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho_atom_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho_atom_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho_atom_methods.mod' due to: qs_rho_atom_methods.o /build/reproducible-path/cp2k-8.1/src/qs_rho_atom_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod sap_kind_types.mod kpoint_types.mod qs_oce_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_control_types.mod qs_rho_atom_types.mod kinds.mod spherical_harmonics.mod qs_harmonics_atom.mod message_passing.mod whittaker.mod qs_grid_atom.mod memory_utilities.mod util.mod orbital_pointers.mod lebedev.mod base_hooks.mod qs_oce_methods.mod mathconstants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_tb_coulomb.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_tb_coulomb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cell_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod atprop_types.mod distribution_1d_types.mod atomic_kind_types.mod ewald_pw_types.mod qs_force_types.mod qmmm_types_low.mod ewald_environment_types.mod qs_energy_types.mod mathconstants.mod kinds.mod ewald_methods_tb.mod message_passing.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_tb_coulomb.F qmmm_tb_coulomb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:21:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_tb_coulomb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_tb_coulomb.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_tb_coulomb.mod' due to: qmmm_tb_coulomb.o /build/reproducible-path/cp2k-8.1/src/qmmm_tb_coulomb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cell_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod atprop_types.mod distribution_1d_types.mod atomic_kind_types.mod ewald_pw_types.mod qs_force_types.mod qmmm_types_low.mod ewald_environment_types.mod qs_energy_types.mod mathconstants.mod kinds.mod ewald_methods_tb.mod message_passing.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_operators_r12.mod' due to: ai_operators_r12.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xtb_coulomb.o' due to: /build/reproducible-path/cp2k-8.1/src/xtb_coulomb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod atprop_types.mod sap_kind_types.mod distribution_1d_types.mod atomic_kind_types.mod ewald_pw_types.mod xtb_types.mod qs_force_types.mod ewald_environment_types.mod qs_energy_types.mod mathconstants.mod kinds.mod virial_methods.mod ewald_methods_tb.mod ai_overlap.mod ai_contraction.mod qs_dftb3_methods.mod message_passing.mod qs_integral_utils.mod qmmm_tb_coulomb.mod base_hooks.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xtb_coulomb.F xtb_coulomb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:21:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_coulomb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_coulomb.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xtb_coulomb.mod' due to: xtb_coulomb.o /build/reproducible-path/cp2k-8.1/src/xtb_coulomb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod atprop_types.mod sap_kind_types.mod distribution_1d_types.mod atomic_kind_types.mod ewald_pw_types.mod xtb_types.mod qs_force_types.mod ewald_environment_types.mod qs_energy_types.mod mathconstants.mod kinds.mod virial_methods.mod ewald_methods_tb.mod ai_overlap.mod ai_contraction.mod qs_dftb3_methods.mod message_passing.mod qs_integral_utils.mod qmmm_tb_coulomb.mod base_hooks.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_contraction_sphi.mod' due to: ai_contraction_sphi.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xtb_matrices.o' due to: /build/reproducible-path/cp2k-8.1/src/xtb_matrices.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod qs_dispersion_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod pair_potential_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_scf_types.mod atprop_types.mod block_p_types.mod atomic_kind_types.mod input_section_types.mod xtb_types.mod qs_force_types.mod ewald_environment_types.mod qs_ks_types.mod qs_energy_types.mod string_utilities.mod mulliken.mod cp_blacs_env.mod kinds.mod qs_charge_mixing.mod pair_potential_util.mod cp_output_handling.mod cp_dbcsr_operations.mod virial_methods.mod xtb_parameters.mod qs_condnum.mod pair_potential.mod ai_overlap.mod ai_contraction.mod qs_dispersion_pairpot.mod message_passing.mod fparser.mod qs_integral_utils.mod efield_tb_methods.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod xtb_coulomb.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xtb_matrices.F xtb_matrices.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:22:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_matrices.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_matrices.F90 -/build/reproducible-path/cp2k-8.1/src/xtb_matrices.F:1466:22: +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_overlap_aabb.mod' due to: ai_overlap_aabb.o +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_operator_ra2m.mod' due to: ai_operator_ra2m.o +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_overlap3.mod' due to: ai_overlap3.o +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_overlap3_debug.mod' due to: ai_overlap3_debug.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'debug_os_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/debug_os_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ai_overlap3.mod kinds.mod orbital_pointers.mod ai_overlap_debug.mod ai_overlap_aabb.mod ai_overlap3_debug.mod ai_overlap.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/debug_os_integrals.F debug_os_integrals.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:32:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"debug_os_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' debug_os_integrals.F90 +/build/reproducible-path/cp2k-8.1/src/debug_os_integrals.F:46:36: - 1466 | IF (iw > 0) WRITE (iw, *) "TESTING ", TRIM(name_atm_a), TRIM(name_atm_b), & - | ^ -Warning: 'iw' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xtb_matrices.F:1442:75: + 46 | SUBROUTINE overlap_ab_test_simple() + | ^ +Warning: 'overlap_ab_test_simple' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/debug_os_integrals.F:191:37: - 1442 | INTEGER :: ikind, ingp, iw, jkind - | ^ -note: 'iw' was declared here -/build/reproducible-path/cp2k-8.1/src/xtb_matrices.F:1517:94: + 191 | SUBROUTINE overlap_abc_test_simple() + | ^ +Warning: 'overlap_abc_test_simple' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/debug_os_integrals.F:386:38: - 1517 | SUBROUTINE xb_interaction(exb, neighbor_atoms, atom_of_kind, kind_of, sab_xb, kx, kx2, rcab, & - | ^ -Warning: 'rcab.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xtb_matrices.F:161:95: + 386 | SUBROUTINE overlap_aabb_test_simple() + | ^ +Warning: 'overlap_aabb_test_simple' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'debug_os_integrals.mod' due to: debug_os_integrals.o /build/reproducible-path/cp2k-8.1/src/debug_os_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ai_overlap3.mod kinds.mod orbital_pointers.mod ai_overlap_debug.mod ai_overlap_aabb.mod ai_overlap3_debug.mod ai_overlap.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constants_operator.o' due to: /build/reproducible-path/cp2k-8.1/src/shg_int/constants_operator.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/shg_int/constants_operator.F constants_operator.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:32:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/constants_operator.F\"" -I'/build/reproducible-path/cp2k-8.1/src/shg_int/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constants_operator.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constants_operator.mod' due to: constants_operator.o /build/reproducible-path/cp2k-8.1/src/shg_int/constants_operator.F +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'generic_os_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/generic_os_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod ai_operators_r12.mod kinds.mod orbital_pointers.mod ai_contraction_sphi.mod ai_overlap_aabb.mod ai_operator_ra2m.mod ai_derivatives.mod ai_overlap.mod debug_os_integrals.mod constants_operator.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/generic_os_integrals.F generic_os_integrals.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:32:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"generic_os_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' generic_os_integrals.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'generic_os_integrals.mod' due to: generic_os_integrals.o /build/reproducible-path/cp2k-8.1/src/generic_os_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod ai_operators_r12.mod kinds.mod orbital_pointers.mod ai_contraction_sphi.mod ai_overlap_aabb.mod ai_operator_ra2m.mod ai_derivatives.mod ai_overlap.mod debug_os_integrals.mod constants_operator.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 's_contract_shg.o' due to: /build/reproducible-path/cp2k-8.1/src/shg_int/s_contract_shg.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod base_hooks.mod gamma.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/shg_int/s_contract_shg.F s_contract_shg.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:33:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/s_contract_shg.F\"" -I'/build/reproducible-path/cp2k-8.1/src/shg_int/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' s_contract_shg.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 's_contract_shg.mod' due to: s_contract_shg.o /build/reproducible-path/cp2k-8.1/src/shg_int/s_contract_shg.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod base_hooks.mod gamma.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'construct_shg.o' due to: /build/reproducible-path/cp2k-8.1/src/shg_int/construct_shg.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod base_hooks.mod mathconstants.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/shg_int/construct_shg.F construct_shg.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:33:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/construct_shg.F\"" -I'/build/reproducible-path/cp2k-8.1/src/shg_int/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' construct_shg.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'construct_shg.mod' due to: construct_shg.o /build/reproducible-path/cp2k-8.1/src/shg_int/construct_shg.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 orbital_pointers.mod base_hooks.mod mathconstants.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'generic_shg_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/shg_int/generic_shg_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod s_contract_shg.mod kinds.mod orbital_pointers.mod constants_operator.mod construct_shg.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/shg_int/generic_shg_integrals.F generic_shg_integrals.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:33:26 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/generic_shg_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/shg_int/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' generic_shg_integrals.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'generic_shg_integrals.mod' due to: generic_shg_integrals.o /build/reproducible-path/cp2k-8.1/src/shg_int/generic_shg_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod s_contract_shg.mod kinds.mod orbital_pointers.mod constants_operator.mod construct_shg.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod lri_environment_types.mod kinds.mod generic_os_integrals.mod generic_shg_integrals.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_integrals.F lri_integrals.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:33:37 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_integrals.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_integrals.mod' due to: lri_integrals.o /build/reproducible-path/cp2k-8.1/src/lri_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod lri_environment_types.mod kinds.mod generic_os_integrals.mod generic_shg_integrals.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_overlap_ppl.mod' due to: ai_overlap_ppl.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'core_ppl.o' due to: /build/reproducible-path/cp2k-8.1/src/core_ppl.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod external_potential_types.mod qs_kind_types.mod atomic_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod lri_environment_types.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_overlap_ppl.mod virial_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/core_ppl.F core_ppl.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:33:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"core_ppl.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' core_ppl.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'core_ppl.mod' due to: core_ppl.o /build/reproducible-path/cp2k-8.1/src/core_ppl.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod external_potential_types.mod qs_kind_types.mod atomic_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod lri_environment_types.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_overlap_ppl.mod virial_methods.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_compression.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_compression.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_compression.F lri_compression.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:34:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_compression.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_compression.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_compression.mod' due to: lri_compression.o /build/reproducible-path/cp2k-8.1/src/lri_compression.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_environment_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_environment_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_control_types.mod lri_environment_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod message_passing.mod lri_integrals.mod qs_collocate_density.mod mathlib.mod generic_os_integrals.mod base_hooks.mod core_ppl.mod input_constants.mod lri_compression.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_environment_methods.F lri_environment_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:34:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_environment_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_environment_methods.F90 +/build/reproducible-path/cp2k-8.1/src/lri_environment_methods.F:481:40: - 161 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :) :: dfblock, huckel, kcnlk, owork, rcab - | ^ -note: 'rcab.dim[1].stride' was declared here -/build/reproducible-path/cp2k-8.1/src/xtb_matrices.F:1399:19: + 481 | SUBROUTINE calculate_lri_overlap_aabb(lri_env, qs_env) + | ^ +Warning: 'calculate_lri_overlap_aabb' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/lri_environment_methods.F:399:65: - 1399 | IF (use_virial) THEN - | ^ -Warning: 'use_virial' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xtb_matrices.F:154:46: + 399 | nspin + | ^ +Warning: 'nspin' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_environment_methods.mod' due to: lri_environment_methods.o /build/reproducible-path/cp2k-8.1/src/lri_environment_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_control_types.mod lri_environment_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod message_passing.mod lri_integrals.mod qs_collocate_density.mod mathlib.mod generic_os_integrals.mod base_hooks.mod core_ppl.mod input_constants.mod lri_compression.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_o3c_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_o3c_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_o3c_types.mod basis_set_types.mod ai_overlap3.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_contraction_sphi.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_o3c_methods.F qs_o3c_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:34:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_o3c_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_o3c_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_o3c_methods.mod' due to: qs_o3c_methods.o /build/reproducible-path/cp2k-8.1/src/qs_o3c_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_o3c_types.mod basis_set_types.mod ai_overlap3.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_contraction_sphi.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ri_environment_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/ri_environment_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_types.mod qs_o3c_types.mod cp_control_types.mod lri_environment_types.mod kinds.mod cp_dbcsr_cp2k_link.mod arnoldi_api.mod cp_dbcsr_operations.mod message_passing.mod qs_collocate_density.mod cp_dbcsr_diag.mod util.mod iterate_matrix.mod cp_blacs_env.mod base_hooks.mod qs_overlap.mod qs_o3c_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ri_environment_methods.F ri_environment_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:34:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ri_environment_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ri_environment_methods.F90 +/build/reproducible-path/cp2k-8.1/src/ri_environment_methods.F:626:23: - 154 | omit_headers, use_arnoldi, use_virial, xb_inter - | ^ -note: 'use_virial' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xtb_matrices.mod' due to: xtb_matrices.o /build/reproducible-path/cp2k-8.1/src/xtb_matrices.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod qs_dispersion_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod pair_potential_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_scf_types.mod atprop_types.mod block_p_types.mod atomic_kind_types.mod input_section_types.mod xtb_types.mod qs_force_types.mod ewald_environment_types.mod qs_ks_types.mod qs_energy_types.mod string_utilities.mod mulliken.mod cp_blacs_env.mod kinds.mod qs_charge_mixing.mod pair_potential_util.mod cp_output_handling.mod cp_dbcsr_operations.mod virial_methods.mod xtb_parameters.mod qs_condnum.mod pair_potential.mod ai_overlap.mod ai_contraction.mod qs_dispersion_pairpot.mod message_passing.mod fparser.mod qs_integral_utils.mod efield_tb_methods.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod xtb_coulomb.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod orbital_pointers.mod + 626 | IF (symm .AND. (iatom /= jatom)) THEN + | ^ +Warning: 'symm' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ri_environment_methods.mod' due to: ri_environment_methods.o /build/reproducible-path/cp2k-8.1/src/ri_environment_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_types.mod qs_o3c_types.mod cp_control_types.mod lri_environment_types.mod kinds.mod cp_dbcsr_cp2k_link.mod arnoldi_api.mod cp_dbcsr_operations.mod message_passing.mod qs_collocate_density.mod cp_dbcsr_diag.mod util.mod iterate_matrix.mod cp_blacs_env.mod base_hooks.mod qs_overlap.mod qs_o3c_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'submatrix_types.o' due to: /build/reproducible-path/cp2k-8.1/src/submatrix_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod util.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/submatrix_types.F submatrix_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:22:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"submatrix_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' submatrix_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'submatrix_types.mod' due to: submatrix_types.o /build/reproducible-path/cp2k-8.1/src/submatrix_types.F util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod pw_pool_types.mod qs_ks_types.mod qs_rho_types.mod qs_oce_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod qs_rho_atom_types.mod task_list_types.mod lri_environment_types.mod cp_log_handling.mod kinds.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod qs_collocate_density.mod qs_rho_atom_methods.mod pw_methods.mod lri_environment_methods.mod base_hooks.mod ri_environment_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho_methods.F qs_rho_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:34:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho_methods.mod' due to: qs_rho_methods.o /build/reproducible-path/cp2k-8.1/src/qs_rho_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod pw_pool_types.mod qs_ks_types.mod qs_rho_types.mod qs_oce_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod qs_rho_atom_types.mod task_list_types.mod lri_environment_types.mod cp_log_handling.mod kinds.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod qs_collocate_density.mod qs_rho_atom_methods.mod pw_methods.mod lri_environment_methods.mod base_hooks.mod ri_environment_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'submatrix_dissection.o' due to: /build/reproducible-path/cp2k-8.1/src/submatrix_dissection.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 submatrix_types.mod base_hooks.mod message_passing.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/submatrix_dissection.F submatrix_dissection.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:22:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"submatrix_dissection.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' submatrix_dissection.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'submatrix_dissection.mod' due to: submatrix_dissection.o /build/reproducible-path/cp2k-8.1/src/submatrix_dissection.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 submatrix_types.mod base_hooks.mod message_passing.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pw_env_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pw_env_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod cell_types.mod dielectric_types.mod pw_poisson_types.mod ps_implicit_types.mod ps_wavelet_types.mod qs_dispersion_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod pw_grid_types.mod qs_rho0_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod pw_grids.mod cp_output_handling.mod cube_utils.mod pw_poisson_methods.mod xc_input_constants.mod dct.mod cp_realspace_grid_init.mod d3_poly.mod pw_poisson_read_input.mod pw_grid_info.mod base_hooks.mod gaussian_gridlevels.mod ao_util.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pw_env_methods.F pw_env_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:34:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pw_env_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pw_env_methods.F90 +/build/reproducible-path/cp2k-8.1/src/pw_env_methods.F:1028:45: + + 1028 | 1, (/-1, -1, -1/)) + | ^ +Warning: 'border_points' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/pw_env_methods.F:797:16: + + 797 | IF (igrid_zet0_s == igrid_level) maxradius = MAX(maxradius, max_rpgf0_s) + | ^ +Warning: 'igrid_zet0_s' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/pw_env_methods.F:751:67: + + 751 | INTEGER :: handle, ibasis_set_type, igrid_level, igrid_zet0_s, ikind, ipgf, iset, ishell, & + | ^ +note: 'igrid_zet0_s' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pw_env_methods.mod' due to: pw_env_methods.o /build/reproducible-path/cp2k-8.1/src/pw_env_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod cell_types.mod dielectric_types.mod pw_poisson_types.mod ps_implicit_types.mod ps_wavelet_types.mod qs_dispersion_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod pw_grid_types.mod qs_rho0_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod pw_grids.mod cp_output_handling.mod cube_utils.mod pw_poisson_methods.mod xc_input_constants.mod dct.mod cp_realspace_grid_init.mod d3_poly.mod pw_poisson_read_input.mod pw_grid_info.mod base_hooks.mod gaussian_gridlevels.mod ao_util.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'iterate_matrix.o' due to: /build/reproducible-path/cp2k-8.1/src/iterate_matrix.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_constants.mod arnoldi_api.mod cp_log_handling.mod mathconstants.mod mathlib.mod message_passing.mod submatrix_dissection.mod base_hooks.mod bibliography.mod machine.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/iterate_matrix.F iterate_matrix.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:22:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"iterate_matrix.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' iterate_matrix.F90 -/build/reproducible-path/cp2k-8.1/src/iterate_matrix.F:2128:32: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'moments_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/moments_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod fist_environment_types.mod qs_kind_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod atomic_kind_types.mod message_passing.mod kinds.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/moments_utils.F moments_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:34:56 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"moments_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' moments_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'moments_utils.mod' due to: moments_utils.o /build/reproducible-path/cp2k-8.1/src/moments_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod fist_environment_types.mod qs_kind_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod atomic_kind_types.mod message_passing.mod kinds.mod base_hooks.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mo_io.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mo_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod qs_mo_types.mod cp_fm_types.mod qs_dftb_types.mod atomic_kind_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_log_handling.mod kinds.mod orbital_transformation_matrices.mod physcon.mod cp_output_handling.mod qs_dftb_utils.mod qs_mo_occupation.mod cp_dbcsr_operations.mod message_passing.mod kahan_sum.mod qs_mo_methods.mod string_utilities.mod cp_files.mod orbital_pointers.mod base_hooks.mod orbital_symbols.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_mo_io.F qs_mo_io.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:34:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mo_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mo_io.F90 +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:679:32: - 2128 | SUBROUTINE matrix_exponential(matrix_exp, matrix, omega, alpha, threshold) + 679 | nspin_read, offset_read, source | ^ -Warning: 'matrix_exponential' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'iterate_matrix.mod' due to: iterate_matrix.o /build/reproducible-path/cp2k-8.1/src/iterate_matrix.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_constants.mod arnoldi_api.mod cp_log_handling.mod mathconstants.mod mathlib.mod message_passing.mod submatrix_dissection.mod base_hooks.mod bibliography.mod machine.mod kinds.mod +Warning: 'offset_read' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:871:31: + + 871 | IF (minbas) THEN + | ^ +Warning: 'minbas' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:922:48: + + 922 | READ (rst_unit) vecbuffer_read + | ^ +Warning: 'vecbuffer_read.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:685:85: + + 685 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: vecbuffer, vecbuffer_read + | ^ +Warning: 'vecbuffer_read.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:682:81: + + 682 | INTEGER, DIMENSION(:, :, :), POINTER :: nso_info, offset_info + | ^ +Warning: 'offset_info.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:879:89: + + 879 | offset_read = offset_info(ishell_read, iset_read, iatom) + | ^ +Warning: 'offset_info.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:682:81: + + 682 | INTEGER, DIMENSION(:, :, :), POINTER :: nso_info, offset_info + | ^ +Warning: 'offset_info.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:953:33: + + 953 | DEALLOCATE (offset_info) + | ^ +Warning: 'offset_info.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:682:68: + + 682 | INTEGER, DIMENSION(:, :, :), POINTER :: nso_info, offset_info + | ^ +Warning: 'nso_info.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:878:34: + + 878 | IF (nso(lshell) == nso_info(ishell_read, iset_read, iatom)) THEN + | ^ +Warning: 'nso_info.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:682:68: + + 682 | INTEGER, DIMENSION(:, :, :), POINTER :: nso_info, offset_info + | ^ +Warning: 'nso_info.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:878:34: + + 878 | IF (nso(lshell) == nso_info(ishell_read, iset_read, iatom)) THEN + | ^ +Warning: 'nso_info.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:681:74: + + 681 | INTEGER, DIMENSION(:, :), POINTER :: l, nshell_info + | ^ +Warning: 'nshell_info.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:681:74: Warning: 'nshell_info.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:681:74: Warning: 'nshell_info.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:680:69: + + 680 | INTEGER, DIMENSION(:), POINTER :: nset_info, nshell + | ^ +Warning: 'nset_info.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:1013:67: + + 1013 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: cmatrix, smatrix + | ^ +Warning: 'cmatrix.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mo_io.F:1013:67: Warning: 'cmatrix.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mo_io.mod' due to: qs_mo_io.o /build/reproducible-path/cp2k-8.1/src/qs_mo_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod qs_mo_types.mod cp_fm_types.mod qs_dftb_types.mod atomic_kind_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_log_handling.mod kinds.mod orbital_transformation_matrices.mod physcon.mod cp_output_handling.mod qs_dftb_utils.mod qs_mo_occupation.mod cp_dbcsr_operations.mod message_passing.mod kahan_sum.mod qs_mo_methods.mod string_utilities.mod cp_files.mod orbital_pointers.mod base_hooks.mod orbital_symbols.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'admm_dm_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/admm_dm_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_dm_types.mod qs_rho_types.mod pw_types.mod cp_control_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod iterate_matrix.mod qs_collocate_density.mod cp_dbcsr_operations.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/admm_dm_methods.F admm_dm_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:23:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_dm_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_dm_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'admm_dm_methods.mod' due to: admm_dm_methods.o /build/reproducible-path/cp2k-8.1/src/admm_dm_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_dm_types.mod qs_rho_types.mod pw_types.mod cp_control_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod iterate_matrix.mod qs_collocate_density.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_wfn_mix.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_wfn_mix.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_mo_types.mod qs_kind_types.mod particle_types.mod cp_fm_types.mod input_section_types.mod kinds.mod qs_mo_methods.mod qs_mo_io.mod base_hooks.mod cp_dbcsr_operations.mod cp_fm_struct.mod cp_fm_basic_linalg.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_wfn_mix.F qs_scf_wfn_mix.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:35:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_wfn_mix.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_wfn_mix.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_wfn_mix.mod' due to: qs_scf_wfn_mix.o /build/reproducible-path/cp2k-8.1/src/qs_scf_wfn_mix.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_mo_types.mod qs_kind_types.mod particle_types.mod cp_fm_types.mod input_section_types.mod kinds.mod qs_mo_methods.mod qs_mo_io.mod base_hooks.mod cp_dbcsr_operations.mod cp_fm_struct.mod cp_fm_basic_linalg.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb_coulomb.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb_coulomb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_dftb_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod atprop_types.mod sap_kind_types.mod distribution_1d_types.mod atomic_kind_types.mod ewald_pw_types.mod qs_force_types.mod ewald_environment_types.mod qs_energy_types.mod mathconstants.mod kinds.mod virial_methods.mod ewald_methods_tb.mod qs_dftb_utils.mod qs_dftb3_methods.mod message_passing.mod qmmm_tb_coulomb.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dftb_coulomb.F qs_dftb_coulomb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:23:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_coulomb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_coulomb.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb_coulomb.mod' due to: qs_dftb_coulomb.o /build/reproducible-path/cp2k-8.1/src/qs_dftb_coulomb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_dftb_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod atprop_types.mod sap_kind_types.mod distribution_1d_types.mod atomic_kind_types.mod ewald_pw_types.mod qs_force_types.mod ewald_environment_types.mod qs_energy_types.mod mathconstants.mod kinds.mod virial_methods.mod ewald_methods_tb.mod qs_dftb_utils.mod qs_dftb3_methods.mod message_passing.mod qmmm_tb_coulomb.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molden_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/molden_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod atomic_kind_types.mod particle_types.mod cp_fm_types.mod qs_mo_types.mod input_section_types.mod cp_log_handling.mod mathconstants.mod kinds.mod orbital_pointers.mod periodic_table.mod base_hooks.mod orbital_transformation_matrices.mod input_constants.mod cp_output_handling.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/molden_utils.F molden_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:35:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molden_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molden_utils.F90 +/build/reproducible-path/cp2k-8.1/src/molden_utils.F:81:67: + + 81 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :) :: cmatrix, smatrix + | ^ +Warning: 'cmatrix.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molden_utils.mod' due to: molden_utils.o /build/reproducible-path/cp2k-8.1/src/molden_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod atomic_kind_types.mod particle_types.mod cp_fm_types.mod qs_mo_types.mod input_section_types.mod cp_log_handling.mod mathconstants.mod kinds.mod orbital_pointers.mod periodic_table.mod base_hooks.mod orbital_transformation_matrices.mod input_constants.mod cp_output_handling.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb_matrices.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb_matrices.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_dftb_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atprop_types.mod block_p_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod qs_energy_types.mod mulliken.mod kinds.mod qs_dftb_coulomb.mod cp_output_handling.mod cp_dbcsr_operations.mod qs_dftb_utils.mod virial_methods.mod message_passing.mod efield_tb_methods.mod cp_dbcsr_cp2k_link.mod particle_methods.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dftb_matrices.F qs_dftb_matrices.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:23:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_matrices.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_matrices.F90 -/build/reproducible-path/cp2k-8.1/src/qs_dftb_matrices.F:419:19: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'stm_images.o' due to: /build/reproducible-path/cp2k-8.1/src/stm_images.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qs_ks_types.mod qs_rho_types.mod qs_mo_types.mod particle_list_types.mod cp_fm_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_realspace_grid_cube.mod qs_collocate_density.mod cp_fm_basic_linalg.mod cp_array_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/stm_images.F stm_images.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:35:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"stm_images.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' stm_images.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'stm_images.mod' due to: stm_images.o /build/reproducible-path/cp2k-8.1/src/stm_images.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qs_ks_types.mod qs_rho_types.mod qs_mo_types.mod particle_list_types.mod cp_fm_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_realspace_grid_cube.mod qs_collocate_density.mod cp_fm_basic_linalg.mod cp_array_utils.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kpoint_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/kpoint_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod scf_control_types.mod cp_fm_pool_types.mod particle_types.mod cell_types.mod qs_mo_types.mod cp_fm_types.mod atomic_kind_types.mod qs_neighbor_list_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_matrix_pools.mod fermi_utils.mod cp_para_env.mod cp_fm_basic_linalg.mod memory_utilities.mod util.mod cp_blacs_env.mod base_hooks.mod mathconstants.mod cryssym.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kpoint_methods.F kpoint_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:35:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_methods.F90 +/build/reproducible-path/cp2k-8.1/src/kpoint_methods.F:342:26: - 419 | IF (use_virial) THEN - | ^ -Warning: 'use_virial' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb_matrices.mod' due to: qs_dftb_matrices.o /build/reproducible-path/cp2k-8.1/src/qs_dftb_matrices.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_dftb_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atprop_types.mod block_p_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod qs_energy_types.mod mulliken.mod kinds.mod qs_dftb_coulomb.mod cp_output_handling.mod cp_dbcsr_operations.mod qs_dftb_utils.mod virial_methods.mod message_passing.mod efield_tb_methods.mod cp_dbcsr_cp2k_link.mod particle_methods.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod + 342 | nkp_grp = npe/ngr + | ^ +Warning: 'ngr' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kpoint_methods.mod' due to: kpoint_methods.o /build/reproducible-path/cp2k-8.1/src/kpoint_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod scf_control_types.mod cp_fm_pool_types.mod particle_types.mod cell_types.mod qs_mo_types.mod cp_fm_types.mod atomic_kind_types.mod qs_neighbor_list_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_matrix_pools.mod fermi_utils.mod cp_para_env.mod cp_fm_basic_linalg.mod memory_utilities.mod util.mod cp_blacs_env.mod base_hooks.mod mathconstants.mod cryssym.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_core_energies.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_core_energies.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod qs_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod qs_neighbor_list_types.mod atprop_types.mod qs_environment_types.mod distribution_1d_types.mod qs_energy_types.mod virial_methods.mod mathconstants.mod message_passing.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_core_energies.F qs_core_energies.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:23:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_core_energies.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_core_energies.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_core_energies.mod' due to: qs_core_energies.o /build/reproducible-path/cp2k-8.1/src/qs_core_energies.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod qs_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod qs_neighbor_list_types.mod atprop_types.mod qs_environment_types.mod distribution_1d_types.mod qs_energy_types.mod virial_methods.mod mathconstants.mod message_passing.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_csr_write.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_neighbor_list_types.mod kpoint_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod kpoint_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F qs_scf_csr_write.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:35:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_csr_write.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_csr_write.F90 +/build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F:275:65: + + 275 | CALL dbcsr_add(cmatrix, tmatrix, cone, ione) + | ^ +Warning: 'tmatrix' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F:273:60: + + 273 | CALL dbcsr_copy(cmatrix, rmatrix_nosym) + | ^ +Warning: 'rmatrix_nosym' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F:274:60: + + 274 | CALL dbcsr_copy(tmatrix, imatrix_nosym) + | ^ +Warning: 'imatrix_nosym' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F:272:68: + + 272 | CALL dbcsr_desymmetrize(imatrix, imatrix_nosym) + | ^ +Warning: 'imatrix' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F:278:70: + + 278 | CALL dbcsr_convert_dbcsr_to_csr(cmatrix, mat_csr) + | ^ +Warning: 'cmatrix' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_csr_write.mod' due to: qs_scf_csr_write.o /build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_neighbor_list_types.mod kpoint_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod kpoint_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_contraction_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_contraction_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_contraction_methods.F hfx_contraction_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:23:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfxbase/hfx_contraction_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/hfxbase/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_contraction_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_contraction_methods.mod' due to: hfx_contraction_methods.o /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_contraction_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_elf_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_elf_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pw_env_types.mod pw_pool_types.mod qs_ks_types.mod pw_types.mod qs_rho_types.mod mathconstants.mod kinds.mod pw_methods.mod base_hooks.mod qs_collocate_density.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_elf_methods.F qs_elf_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:35:32 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_elf_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_elf_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_elf_methods.mod' due to: qs_elf_methods.o /build/reproducible-path/cp2k-8.1/src/qs_elf_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pw_env_types.mod pw_pool_types.mod qs_ks_types.mod pw_types.mod qs_rho_types.mod mathconstants.mod kinds.mod pw_methods.mod base_hooks.mod qs_collocate_density.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_libint_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_libint_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod cell_types.mod hfx_contraction_methods.mod input_constants.mod gamma.mod t_c_g0.mod base_hooks.mod mathconstants.mod libint_wrapper.mod orbital_pointers.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_libint_interface.F hfx_libint_interface.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:26:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_libint_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_libint_interface.F90 -/build/reproducible-path/cp2k-8.1/src/hfx_libint_interface.F:259:37: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_pdos.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_pdos.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod pw_pool_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_mo_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod qs_ot_eigensolver.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_mo_methods.mod qs_collocate_density.mod memory_utilities.mod orbital_pointers.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod orbital_symbols.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_pdos.F qs_pdos.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:35:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_pdos.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_pdos.F90 +/build/reproducible-path/cp2k-8.1/src/qs_pdos.F:888:21: - 259 | factor = factor*S1234*SQRT(tmp) - | ^ -Warning: 'factor' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_libint_interface.mod' due to: hfx_libint_interface.o /build/reproducible-path/cp2k-8.1/src/hfx_libint_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod cell_types.mod hfx_contraction_methods.mod input_constants.mod gamma.mod t_c_g0.mod base_hooks.mod mathconstants.mod libint_wrapper.mod orbital_pointers.mod kinds.mod + 888 | IF (.NOT. read_r(3, ildos)) THEN + | ^ +Warning: 'read_r.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_pdos.F:663:95: + + 663 | r_ldos_p(ildos)%ldos%pdos_array(imo) = r_ldos_p(ildos)%ldos%pdos_array(imo)*dvol + | ^ +Warning: 'dvol' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_pdos.mod' due to: qs_pdos.o /build/reproducible-path/cp2k-8.1/src/qs_pdos.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod pw_pool_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_mo_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod qs_ot_eigensolver.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_mo_methods.mod qs_collocate_density.mod memory_utilities.mod orbital_pointers.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod orbital_symbols.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_screening_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_screening_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod hfx_types.mod qs_environment_types.mod ao_util.mod hfx_libint_interface.mod base_hooks.mod libint_wrapper.mod powell.mod machine.mod orbital_pointers.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_screening_methods.F hfx_screening_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:26:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_screening_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_screening_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_screening_methods.mod' due to: hfx_screening_methods.o /build/reproducible-path/cp2k-8.1/src/hfx_screening_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod hfx_types.mod qs_environment_types.mod ao_util.mod hfx_libint_interface.mod base_hooks.mod libint_wrapper.mod powell.mod machine.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_post_tb.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_post_tb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod preconditioner_types.mod pw_pool_types.mod qs_ks_types.mod cp_result_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod pw_poisson_types.mod qs_scf_types.mod particle_list_types.mod xtb_types.mod cp_fm_types.mod qs_dftb_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod scf_control_types.mod cp_control_types.mod task_list_types.mod qs_dos.mod cp_log_handling.mod qs_ot_eigensolver.mod kinds.mod cp_output_handling.mod physcon.mod population_analyses.mod qs_dftb_utils.mod qs_energy_window.mod qs_rho_methods.mod cp_fm_struct.mod pw_env_methods.mod qs_mo_occupation.mod cp_dbcsr_operations.mod cp_realspace_grid_cube.mod qs_mo_methods.mod mulliken.mod cp_fm_cholesky.mod task_list_methods.mod qs_collocate_density.mod moments_utils.mod qs_scf_wfn_mix.mod memory_utilities.mod cp_result_methods.mod cp_array_utils.mod pw_methods.mod cp_blacs_env.mod molden_utils.mod machine.mod base_hooks.mod stm_images.mod mathconstants.mod qs_scf_csr_write.mod cp_fm_diag.mod qs_elf_methods.mod qs_mo_io.mod input_constants.mod qs_pdos.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_post_tb.F qs_scf_post_tb.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:35:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_post_tb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_post_tb.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_post_tb.mod' due to: qs_scf_post_tb.o /build/reproducible-path/cp2k-8.1/src/qs_scf_post_tb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod preconditioner_types.mod pw_pool_types.mod qs_ks_types.mod cp_result_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod pw_poisson_types.mod qs_scf_types.mod particle_list_types.mod xtb_types.mod cp_fm_types.mod qs_dftb_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod scf_control_types.mod cp_control_types.mod task_list_types.mod qs_dos.mod cp_log_handling.mod qs_ot_eigensolver.mod kinds.mod cp_output_handling.mod physcon.mod population_analyses.mod qs_dftb_utils.mod qs_energy_window.mod qs_rho_methods.mod cp_fm_struct.mod pw_env_methods.mod qs_mo_occupation.mod cp_dbcsr_operations.mod cp_realspace_grid_cube.mod qs_mo_methods.mod mulliken.mod cp_fm_cholesky.mod task_list_methods.mod qs_collocate_density.mod moments_utils.mod qs_scf_wfn_mix.mod memory_utilities.mod cp_result_methods.mod cp_array_utils.mod pw_methods.mod cp_blacs_env.mod molden_utils.mod machine.mod base_hooks.mod stm_images.mod mathconstants.mod qs_scf_csr_write.mod cp_fm_diag.mod qs_elf_methods.mod qs_mo_io.mod input_constants.mod qs_pdos.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'basis_set_output.o' due to: /build/reproducible-path/cp2k-8.1/src/basis_set_output.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_log_handling.mod cp_files.mod kinds.mod cp2k_info.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/basis_set_output.F basis_set_output.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:35:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"basis_set_output.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' basis_set_output.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'basis_set_output.mod' due to: basis_set_output.o /build/reproducible-path/cp2k-8.1/src/basis_set_output.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_log_handling.mod cp_files.mod kinds.mod cp2k_info.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_external_control.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_external_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_files.mod machine.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_external_control.F cp_external_control.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:35:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_external_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_external_control.F90 +/build/reproducible-path/cp2k-8.1/src/cp_external_control.F:208:53: + + 208 | time_check = m_walltime() - my_start_time + | ^ +Warning: 'my_start_time' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_external_control.mod' due to: cp_external_control.o /build/reproducible-path/cp2k-8.1/src/cp_external_control.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_files.mod machine.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'matrix_exp.o' due to: /build/reproducible-path/cp2k-8.1/src/matrix_exp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_cfm_types.mod cp_fm_types.mod message_passing.mod cp_cfm_basic_linalg.mod cp_log_handling.mod kinds.mod mathconstants.mod cp_gemm_interface.mod cp_fm_struct.mod cp_fm_basic_linalg.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/matrix_exp.F matrix_exp.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:36:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"matrix_exp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' matrix_exp.F90 +/build/reproducible-path/cp2k-8.1/src/matrix_exp.F:518:89: + + 518 | Npq%local_data(:, k) = Npq%local_data(:, k) + scaleN*Tres%local_data(:, k) + | ^ +Warning: 'REALPART_EXPR ' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'matrix_exp.mod' due to: matrix_exp.o /build/reproducible-path/cp2k-8.1/src/matrix_exp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_cfm_types.mod cp_fm_types.mod message_passing.mod cp_cfm_basic_linalg.mod cp_log_handling.mod kinds.mod mathconstants.mod cp_gemm_interface.mod cp_fm_struct.mod cp_fm_basic_linalg.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_localization_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_localization_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod cp_fm_types.mod cp_cfm_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_external_control.mod cp_cfm_basic_linalg.mod cp_cfm_diag.mod cp_fm_basic_linalg.mod matrix_exp.mod cp_blacs_env.mod machine.mod base_hooks.mod mathconstants.mod cp_fm_diag.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_localization_methods.F qs_localization_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:36:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_localization_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_localization_methods.F90 +/build/reproducible-path/cp2k-8.1/src/qs_localization_methods.F:1802:71: + + 1802 | ii = nblock_max*ip_has_i + i - ns_bound(ip_has_i, 1) + 1 + | ^ +Warning: 'ip_has_i' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_localization_methods.F:1374:64: + + 1374 | REAL(dp), ALLOCATABLE, DIMENSION(:, :) :: gmat, rmat_loc, rmat_recv, rmat_send, & + | ^ +Warning: 'gmat.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_localization_methods.F:1374:64: Warning: 'gmat.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_localization_methods.mod' due to: qs_localization_methods.o /build/reproducible-path/cp2k-8.1/src/qs_localization_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod cp_fm_types.mod cp_cfm_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_external_control.mod cp_cfm_basic_linalg.mod cp_cfm_diag.mod cp_fm_basic_linalg.mod matrix_exp.mod cp_blacs_env.mod machine.mod base_hooks.mod mathconstants.mod cp_fm_diag.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_loc_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_loc_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_mo_types.mod qs_scf_types.mod qs_loc_types.mod cp_fm_types.mod block_p_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod ai_moments.mod message_passing.mod qs_mo_methods.mod cp_fm_basic_linalg.mod memory_utilities.mod qs_localization_methods.mod cp_array_utils.mod cp_files.mod orbital_pointers.mod base_hooks.mod mathconstants.mod cp_fm_diag.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_loc_utils.F qs_loc_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:36:26 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_utils.F90 +/build/reproducible-path/cp2k-8.1/src/qs_loc_utils.F:819:13: + + 819 | IF (jatom /= last_jatom) THEN + | ^ +Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_loc_utils.F:539:25: + + 539 | IF (ABS(occ_imo - my_occ) > localized_wfn_control%eps_occ) THEN + | ^ +Warning: 'my_occ' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_loc_utils.mod' due to: qs_loc_utils.o /build/reproducible-path/cp2k-8.1/src/qs_loc_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_mo_types.mod qs_scf_types.mod qs_loc_types.mod cp_fm_types.mod block_p_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod ai_moments.mod message_passing.mod qs_mo_methods.mod cp_fm_basic_linalg.mod memory_utilities.mod qs_localization_methods.mod cp_array_utils.mod cp_files.mod orbital_pointers.mod base_hooks.mod mathconstants.mod cp_fm_diag.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_loc_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_loc_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod cp_fm_pool_types.mod particle_types.mod cell_types.mod qs_mo_types.mod particle_list_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_matrix_pools.mod cp_realspace_grid_cube.mod qs_collocate_density.mod string_utilities.mod motion_utils.mod memory_utilities.mod qs_localization_methods.mod qs_loc_utils.mod particle_methods.mod machine.mod base_hooks.mod mathconstants.mod input_constants.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_loc_methods.F qs_loc_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:36:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_loc_methods.mod' due to: qs_loc_methods.o /build/reproducible-path/cp2k-8.1/src/qs_loc_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod cp_fm_pool_types.mod particle_types.mod cell_types.mod qs_mo_types.mod particle_list_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_matrix_pools.mod cp_realspace_grid_cube.mod qs_collocate_density.mod string_utilities.mod motion_utils.mod memory_utilities.mod qs_localization_methods.mod qs_loc_utils.mod particle_methods.mod machine.mod base_hooks.mod mathconstants.mod input_constants.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_vxc_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod xc_rho_cflags_types.mod xc_derivative_set_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod xc_rho_set_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_atom_types.mod kinds.mod qs_harmonics_atom.mod message_passing.mod qs_grid_atom.mod memory_utilities.mod util.mod orbital_pointers.mod xc_derivatives.mod base_hooks.mod xc_atom.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F qs_vxc_atom.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:36:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_vxc_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_vxc_atom.F90 +/build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F:318:105: + + 318 | ir, rho_nlcc(:, 1), rho_h, rho_s, rho_nlcc(:, 2), drho_h, drho_s) + | ^ +Warning: 'rho_nlcc.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F:113:75: + + 113 | REAL(dp), DIMENSION(:, :), POINTER :: rho_h, rho_nlcc, rho_s, weight + | ^ +Warning: 'rho_nlcc.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F:113:75: Warning: 'rho_nlcc.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F:113:75: Warning: 'rho_nlcc.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_vxc_atom.mod' due to: qs_vxc_atom.o /build/reproducible-path/cp2k-8.1/src/qs_vxc_atom.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod xc_rho_cflags_types.mod xc_derivative_set_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod xc_rho_set_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_atom_types.mod kinds.mod qs_harmonics_atom.mod message_passing.mod qs_grid_atom.mod memory_utilities.mod util.mod orbital_pointers.mod xc_derivatives.mod base_hooks.mod xc_atom.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dft_plus_u.o' due to: /build/reproducible-path/cp2k-8.1/src/dft_plus_u.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod qs_rho_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_output_handling.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod cp_dbcsr_output.mod cp_fm_basic_linalg.mod mathlib.mod particle_methods.mod cp_blacs_env.mod base_hooks.mod input_constants.mod orbital_symbols.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dft_plus_u.F dft_plus_u.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:37:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dft_plus_u.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dft_plus_u.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dft_plus_u.mod' due to: dft_plus_u.o /build/reproducible-path/cp2k-8.1/src/dft_plus_u.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod qs_rho_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_output_handling.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod cp_dbcsr_output.mod cp_fm_basic_linalg.mod mathlib.mod particle_methods.mod cp_blacs_env.mod base_hooks.mod input_constants.mod orbital_symbols.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_communication.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_communication.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod qs_environment_types.mod cp_control_types.mod atomic_kind_types.mod particle_types.mod message_passing.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_communication.F hfx_communication.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:37:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_communication.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_communication.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_communication.mod' due to: hfx_communication.o /build/reproducible-path/cp2k-8.1/src/hfx_communication.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod qs_environment_types.mod cp_control_types.mod atomic_kind_types.mod particle_types.mod message_passing.mod kinds.mod base_hooks.mod true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 't_sh_p_s_c.mod' due to: t_sh_p_s_c.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_pair_list_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_pair_list_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod hfx_types.mod cell_types.mod particle_types.mod input_constants.mod gamma.mod t_c_g0.mod mathconstants.mod base_hooks.mod libint_wrapper.mod t_sh_p_s_c.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_pair_list_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_pair_list_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod hfx_types.mod particle_types.mod cell_types.mod t_sh_p_s_c.mod mathconstants.mod libint_wrapper.mod kinds.mod input_constants.mod t_c_g0.mod gamma.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_pair_list_methods.F hfx_pair_list_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:26:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_pair_list_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_pair_list_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:37:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_pair_list_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_pair_list_methods.F90 /build/reproducible-path/cp2k-8.1/src/hfx_pair_list_methods.F:295:46: 295 | factor = factor*S1234*SQRT(tmp) | ^ Warning: 'factor' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_pair_list_methods.mod' due to: hfx_pair_list_methods.o /build/reproducible-path/cp2k-8.1/src/hfx_pair_list_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod hfx_types.mod cell_types.mod particle_types.mod input_constants.mod gamma.mod t_c_g0.mod mathconstants.mod base_hooks.mod libint_wrapper.mod t_sh_p_s_c.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_pair_list_methods.mod' due to: hfx_pair_list_methods.o /build/reproducible-path/cp2k-8.1/src/hfx_pair_list_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod hfx_types.mod particle_types.mod cell_types.mod t_sh_p_s_c.mod mathconstants.mod libint_wrapper.mod kinds.mod input_constants.mod t_c_g0.mod gamma.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_communication.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_communication.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod hfx_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod message_passing.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_communication.F hfx_communication.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:27:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_communication.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_communication.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_communication.mod' due to: hfx_communication.o /build/reproducible-path/cp2k-8.1/src/hfx_communication.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod hfx_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod message_passing.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_contraction_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_contraction_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_contraction_methods.F hfx_contraction_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:37:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfxbase/hfx_contraction_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/hfxbase/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_contraction_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_contraction_methods.mod' due to: hfx_contraction_methods.o /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_contraction_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_libint_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_libint_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod cell_types.mod hfx_contraction_methods.mod mathconstants.mod libint_wrapper.mod kinds.mod orbital_pointers.mod input_constants.mod t_c_g0.mod gamma.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_libint_interface.F hfx_libint_interface.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:39:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_libint_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_libint_interface.F90 +/build/reproducible-path/cp2k-8.1/src/hfx_libint_interface.F:259:37: + + 259 | factor = factor*S1234*SQRT(tmp) + | ^ +Warning: 'factor' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_libint_interface.mod' due to: hfx_libint_interface.o /build/reproducible-path/cp2k-8.1/src/hfx_libint_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hfx_types.mod cell_types.mod hfx_contraction_methods.mod mathconstants.mod libint_wrapper.mod kinds.mod orbital_pointers.mod input_constants.mod t_c_g0.mod gamma.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_screening_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_screening_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod hfx_types.mod basis_set_types.mod qs_kind_types.mod ao_util.mod libint_wrapper.mod kinds.mod orbital_pointers.mod hfx_libint_interface.mod powell.mod machine.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_screening_methods.F hfx_screening_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:39:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_screening_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_screening_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_screening_methods.mod' due to: hfx_screening_methods.o /build/reproducible-path/cp2k-8.1/src/hfx_screening_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod hfx_types.mod basis_set_types.mod qs_kind_types.mod ao_util.mod libint_wrapper.mod kinds.mod orbital_pointers.mod hfx_libint_interface.mod powell.mod machine.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_load_balance_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_load_balance_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod parallel_rng_types.mod cell_types.mod particle_types.mod input_constants.mod hfx_pair_list_methods.mod base_hooks.mod message_passing.mod cp_files.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_load_balance_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_load_balance_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod parallel_rng_types.mod particle_types.mod cell_types.mod message_passing.mod util.mod cp_files.mod kinds.mod input_constants.mod hfx_pair_list_methods.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_load_balance_methods.F hfx_load_balance_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:27:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_load_balance_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_load_balance_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:40:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_load_balance_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_load_balance_methods.F90 /build/reproducible-path/cp2k-8.1/src/hfx_load_balance_methods.F:2360:45: 2360 | shm_bins_per_rank(i_thread + 1) = nbins @@ -42154,11 +42431,11 @@ 1546 | bin_histogram(my_process_id + 1, 1) = my_bin_size | ^ Warning: 'my_bin_size' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_load_balance_methods.mod' due to: hfx_load_balance_methods.o /build/reproducible-path/cp2k-8.1/src/hfx_load_balance_methods.F /build/reproducible-path/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod parallel_rng_types.mod cell_types.mod particle_types.mod input_constants.mod hfx_pair_list_methods.mod base_hooks.mod message_passing.mod cp_files.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_load_balance_methods.mod' due to: hfx_load_balance_methods.o /build/reproducible-path/cp2k-8.1/src/hfx_load_balance_methods.F /build/reproducible-path/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod parallel_rng_types.mod particle_types.mod cell_types.mod message_passing.mod util.mod cp_files.mod kinds.mod input_constants.mod hfx_pair_list_methods.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_derivatives.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_derivatives.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod cell_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod machine.mod input_constants.mod mathconstants.mod cp_files.mod util.mod kinds.mod hfx_screening_methods.mod t_c_g0.mod hfx_pair_list_methods.mod cp_output_handling.mod hfx_communication.mod hfx_libint_interface.mod message_passing.mod libint_wrapper.mod hfx_compression_methods.mod gamma.mod cp_log_handling.mod base_hooks.mod hfx_load_balance_methods.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_derivatives.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_derivatives.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod particle_types.mod cell_types.mod qs_force_types.mod admm_types.mod atomic_kind_types.mod qs_environment_types.mod input_section_types.mod virial_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod gamma.mod message_passing.mod libint_wrapper.mod t_c_g0.mod util.mod cp_files.mod orbital_pointers.mod hfx_communication.mod hfx_pair_list_methods.mod hfx_compression_methods.mod machine.mod hfx_screening_methods.mod base_hooks.mod hfx_load_balance_methods.mod mathconstants.mod hfx_libint_interface.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_derivatives.F hfx_derivatives.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:27:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_derivatives.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_derivatives.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:40:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_derivatives.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_derivatives.F90 /build/reproducible-path/cp2k-8.1/src/hfx_derivatives.F:178:60: 178 | max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, shm_pmax_block, & @@ -42382,16 +42659,107 @@ 194 | TYPE(hfx_cache_type), POINTER :: maxval_cache | ^ note: 'maxval_cache' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_derivatives.mod' due to: hfx_derivatives.o /build/reproducible-path/cp2k-8.1/src/hfx_derivatives.F /build/reproducible-path/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod cell_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod machine.mod input_constants.mod mathconstants.mod cp_files.mod util.mod kinds.mod hfx_screening_methods.mod t_c_g0.mod hfx_pair_list_methods.mod cp_output_handling.mod hfx_communication.mod hfx_libint_interface.mod message_passing.mod libint_wrapper.mod hfx_compression_methods.mod gamma.mod cp_log_handling.mod base_hooks.mod hfx_load_balance_methods.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_derivatives.mod' due to: hfx_derivatives.o /build/reproducible-path/cp2k-8.1/src/hfx_derivatives.F /build/reproducible-path/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod particle_types.mod cell_types.mod qs_force_types.mod admm_types.mod atomic_kind_types.mod qs_environment_types.mod input_section_types.mod virial_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod gamma.mod message_passing.mod libint_wrapper.mod t_c_g0.mod util.mod cp_files.mod orbital_pointers.mod hfx_communication.mod hfx_pair_list_methods.mod hfx_compression_methods.mod machine.mod hfx_screening_methods.mod base_hooks.mod hfx_load_balance_methods.mod mathconstants.mod hfx_libint_interface.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_adiabatic_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/xc_adiabatic_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_energy_types.mod qs_mo_types.mod mathconstants.mod kinds.mod input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc_adiabatic_methods.F xc_adiabatic_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:40:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc_adiabatic_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_adiabatic_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_adiabatic_methods.mod' due to: xc_adiabatic_methods.o /build/reproducible-path/cp2k-8.1/src/xc_adiabatic_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_energy_types.mod qs_mo_types.mod mathconstants.mod kinds.mod input_constants.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dispersion_nonloc.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_grid_types.mod pw_pool_types.mod pw_types.mod qs_dispersion_types.mod virial_types.mod message_passing.mod mathconstants.mod kinds.mod cp_files.mod pw_methods.mod base_hooks.mod input_constants.mod bibliography.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F qs_dispersion_nonloc.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:40:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dispersion_nonloc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dispersion_nonloc.F90 +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:598:61: + + 598 | REAL(KIND=dp) :: g, g2, g2_last, g_multiplier, gm + | ^ +Warning: 'g' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:854:32: + + 854 | IF (use_virial .AND. ABS(prefactor) > 0.0_dp) THEN + | ^ +Warning: 'prefactor' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:760:84: + + 760 | dq_6, e, f, P, prefactor, tmp_1_2, & + | ^ +note: 'prefactor' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:1051:105: + + 1051 | dq0_dgradrho(i_grid) = total_rho(i_grid)*dq0_dq*2.0_dp*(-Z_ab)/(36.0_dp*kF*total_rho(i_grid)**2) + | ^ +Warning: 'z_ab' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:975:86: + + 975 | q_min, r_s, sqrt_r_s, Z_ab + | ^ +note: 'z_ab' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:1189:118: + + 1189 | *(gradient_rho(i_grid, 1)**2 + gradient_rho(i_grid, 2)**2 + gradient_rho(i_grid, 3)**2) + | ^ +Warning: 'z_ab' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F:1158:86: + + 1158 | q_min, r_s, sqrt_r_s, Z_ab + | ^ +note: 'z_ab' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dispersion_nonloc.mod' due to: qs_dispersion_nonloc.o /build/reproducible-path/cp2k-8.1/src/qs_dispersion_nonloc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_grid_types.mod pw_pool_types.mod pw_types.mod qs_dispersion_types.mod virial_types.mod message_passing.mod mathconstants.mod kinds.mod cp_files.mod pw_methods.mod base_hooks.mod input_constants.mod bibliography.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_vxc.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_vxc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_env_types.mod pw_pool_types.mod cp_control_types.mod qs_ks_types.mod pw_types.mod qs_dispersion_types.mod cell_types.mod qs_rho_types.mod input_section_types.mod virial_types.mod qs_dispersion_nonloc.mod kinds.mod pw_methods.mod pw_grids.mod base_hooks.mod input_constants.mod xc.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_vxc.F qs_vxc.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:40:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_vxc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_vxc.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_vxc.mod' due to: qs_vxc.o /build/reproducible-path/cp2k-8.1/src/qs_vxc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_env_types.mod pw_pool_types.mod cp_control_types.mod qs_ks_types.mod pw_types.mod qs_dispersion_types.mod cell_types.mod qs_rho_types.mod input_section_types.mod virial_types.mod qs_dispersion_nonloc.mod kinds.mod pw_methods.mod pw_grids.mod base_hooks.mod input_constants.mod xc.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_adiabatic_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/xc_adiabatic_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_ks_types.mod cp_control_types.mod pw_types.mod qs_energy_types.mod qs_rho_types.mod input_section_types.mod qs_vxc_atom.mod kinds.mod hfx_communication.mod base_hooks.mod input_constants.mod hfx_derivatives.mod xc_adiabatic_methods.mod qs_vxc.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc_adiabatic_utils.F xc_adiabatic_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:40:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc_adiabatic_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_adiabatic_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_adiabatic_utils.mod' due to: xc_adiabatic_utils.o /build/reproducible-path/cp2k-8.1/src/xc_adiabatic_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_ks_types.mod cp_control_types.mod pw_types.mod qs_energy_types.mod qs_rho_types.mod input_section_types.mod qs_vxc_atom.mod kinds.mod hfx_communication.mod base_hooks.mod input_constants.mod hfx_derivatives.mod xc_adiabatic_methods.mod qs_vxc.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tensors.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tensors.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod kpoint_types.mod particle_types.mod cell_types.mod molecule_types.mod qs_tensors_types.mod block_p_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod cp_control_types.mod kinds.mod ai_contraction_sphi.mod cp_dbcsr_cp2k_link.mod ai_overlap.mod gamma.mod libint_wrapper.mod qs_neighbor_lists.mod t_c_g0.mod ai_contraction.mod libint_2c_3c.mod cp_array_utils.mod cp_files.mod orbital_pointers.mod hfx_compression_methods.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tensors.F qs_tensors.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:40:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tensors.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tensors.F90 +/build/reproducible-path/cp2k-8.1/src/qs_tensors.F:783:49: + + 783 | ak%array(1:blk_cnt) = tmp(:) + | ^ +Warning: 'blk_cnt' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_tensors.F:617:24: + + 617 | INTEGER :: blk_cnt, handle, i, i_img, iatom, iblk, ikind, iproc, j_img, jatom, jcell, jkind, & + | ^ +note: 'blk_cnt' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tensors.mod' due to: qs_tensors.o /build/reproducible-path/cp2k-8.1/src/qs_tensors.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod kpoint_types.mod particle_types.mod cell_types.mod molecule_types.mod qs_tensors_types.mod block_p_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod cp_control_types.mod kinds.mod ai_contraction_sphi.mod cp_dbcsr_cp2k_link.mod ai_overlap.mod gamma.mod libint_wrapper.mod qs_neighbor_lists.mod t_c_g0.mod ai_contraction.mod libint_2c_3c.mod cp_array_utils.mod cp_files.mod orbital_pointers.mod hfx_compression_methods.mod base_hooks.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_ri.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_ri.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod qs_ks_types.mod particle_types.mod qs_mo_types.mod qs_loc_types.mod cp_fm_types.mod qs_tensors_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_control_types.mod kinds.mod qs_loc_methods.mod qs_interactions.mod arnoldi_api.mod cp_dbcsr_operations.mod message_passing.mod qs_integral_utils.mod cp_dbcsr_diag.mod util.mod cp_dbcsr_cholesky.mod cp_array_utils.mod iterate_matrix.mod qs_loc_utils.mod particle_methods.mod cp_blacs_env.mod input_cp2k_hfx.mod machine.mod base_hooks.mod qs_tensors.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_ri.F hfx_ri.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:41:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_ri.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_ri.F90 +/build/reproducible-path/cp2k-8.1/src/hfx_ri.F:701:35: + + 701 | SUBROUTINE sort_unique_blkind_2d(blk_ind) + | ^ +Warning: 'sort_unique_blkind_2d' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/hfx_ri.F:863:70: + + 863 | DEALLOCATE (occupied_orbs, occupied_evals, homo_localized) + | ^ +Warning: 'occupied_orbs.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/hfx_ri.F:863:70: Warning: 'occupied_evals.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_ri.mod' due to: hfx_ri.o /build/reproducible-path/cp2k-8.1/src/hfx_ri.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod qs_ks_types.mod particle_types.mod qs_mo_types.mod qs_loc_types.mod cp_fm_types.mod qs_tensors_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_control_types.mod kinds.mod qs_loc_methods.mod qs_interactions.mod arnoldi_api.mod cp_dbcsr_operations.mod message_passing.mod qs_integral_utils.mod cp_dbcsr_diag.mod util.mod cp_dbcsr_cholesky.mod cp_array_utils.mod iterate_matrix.mod qs_loc_utils.mod particle_methods.mod cp_blacs_env.mod input_cp2k_hfx.mod machine.mod base_hooks.mod qs_tensors.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_pw_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_pw_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod cell_types.mod qs_mo_types.mod pw_poisson_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod pw_poisson_methods.mod qs_collocate_density.mod pw_methods.mod base_hooks.mod mathconstants.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_pw_methods.F hfx_pw_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:41:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_pw_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_pw_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_pw_methods.mod' due to: hfx_pw_methods.o /build/reproducible-path/cp2k-8.1/src/hfx_pw_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod cell_types.mod qs_mo_types.mod pw_poisson_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod pw_poisson_methods.mod qs_collocate_density.mod pw_methods.mod base_hooks.mod mathconstants.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_contract_block.o' due to: /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_contract_block.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_contract_block.o' due to: /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_contract_block.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_contract_block.F hfx_contract_block.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:28:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfxbase/hfx_contract_block.F\"" -I'/build/reproducible-path/cp2k-8.1/src/hfxbase/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_contract_block.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_contract_block.mod' due to: hfx_contract_block.o /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_contract_block.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:41:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfxbase/hfx_contract_block.F\"" -I'/build/reproducible-path/cp2k-8.1/src/hfxbase/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_contract_block.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_contract_block.mod' due to: hfx_contract_block.o /build/reproducible-path/cp2k-8.1/src/hfxbase/hfx_contract_block.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_energy_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_energy_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod kpoint_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod machine.mod input_constants.mod mathconstants.mod hfx_contract_block.mod cp_files.mod util.mod kinds.mod hfx_screening_methods.mod t_c_g0.mod hfx_pair_list_methods.mod cp_output_handling.mod hfx_communication.mod hfx_libint_interface.mod message_passing.mod libint_wrapper.mod bibliography.mod hfx_compression_methods.mod gamma.mod cp_log_handling.mod base_hooks.mod hfx_load_balance_methods.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_energy_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_energy_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod gamma.mod bibliography.mod message_passing.mod hfx_contract_block.mod libint_wrapper.mod t_c_g0.mod util.mod cp_files.mod orbital_pointers.mod hfx_communication.mod hfx_pair_list_methods.mod hfx_compression_methods.mod machine.mod base_hooks.mod hfx_screening_methods.mod hfx_load_balance_methods.mod mathconstants.mod hfx_libint_interface.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_energy_potential.F hfx_energy_potential.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:30:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_energy_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_energy_potential.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:43:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_energy_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_energy_potential.F90 /build/reproducible-path/cp2k-8.1/src/hfx_energy_potential.F:205:74: 205 | full_ks_beta, max_contraction, ptr_p_1, ptr_p_2, ptr_p_3, ptr_p_4, shm_pmax_atom, & @@ -42608,131 +42976,82 @@ 224 | TYPE(hfx_container_type), POINTER :: maxval_container, maxval_container_disk | ^ -note: 'maxval_container_disk' was declared here -/build/reproducible-path/cp2k-8.1/src/hfx_energy_potential.F:2122:60: - - 2122 | do_disk_storage) - | ^ -Warning: 'maxval_cache_disk' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/hfx_energy_potential.F:221:91: - - 221 | TYPE(hfx_cache_type), POINTER :: maxval_cache, maxval_cache_disk - | ^ -note: 'maxval_cache_disk' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_energy_potential.mod' due to: hfx_energy_potential.o /build/reproducible-path/cp2k-8.1/src/hfx_energy_potential.F /build/reproducible-path/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod kpoint_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod machine.mod input_constants.mod mathconstants.mod hfx_contract_block.mod cp_files.mod util.mod kinds.mod hfx_screening_methods.mod t_c_g0.mod hfx_pair_list_methods.mod cp_output_handling.mod hfx_communication.mod hfx_libint_interface.mod message_passing.mod libint_wrapper.mod bibliography.mod hfx_compression_methods.mod gamma.mod cp_log_handling.mod base_hooks.mod hfx_load_balance_methods.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_contraction_sphi.mod' due to: ai_contraction_sphi.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tensors.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tensors.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod qs_tensors_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod distribution_1d_types.mod block_p_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod input_constants.mod libint_2c_3c.mod cp_files.mod kinds.mod t_c_g0.mod cp_array_utils.mod ai_overlap.mod ai_contraction.mod libint_wrapper.mod cp_dbcsr_cp2k_link.mod hfx_compression_methods.mod ai_contraction_sphi.mod gamma.mod base_hooks.mod qs_neighbor_lists.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tensors.F qs_tensors.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:30:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tensors.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tensors.F90 -/build/reproducible-path/cp2k-8.1/src/qs_tensors.F:783:49: - - 783 | ak%array(1:blk_cnt) = tmp(:) - | ^ -Warning: 'blk_cnt' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_tensors.F:617:24: - - 617 | INTEGER :: blk_cnt, handle, i, i_img, iatom, iblk, ikind, iproc, j_img, jatom, jcell, jkind, & - | ^ -note: 'blk_cnt' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tensors.mod' due to: qs_tensors.o /build/reproducible-path/cp2k-8.1/src/qs_tensors.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod qs_tensors_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod distribution_1d_types.mod block_p_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod input_constants.mod libint_2c_3c.mod cp_files.mod kinds.mod t_c_g0.mod cp_array_utils.mod ai_overlap.mod ai_contraction.mod libint_wrapper.mod cp_dbcsr_cp2k_link.mod hfx_compression_methods.mod ai_contraction_sphi.mod gamma.mod base_hooks.mod qs_neighbor_lists.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_external_control.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_external_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_files.mod machine.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_external_control.F cp_external_control.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:31:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_external_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_external_control.F90 -/build/reproducible-path/cp2k-8.1/src/cp_external_control.F:208:53: - - 208 | time_check = m_walltime() - my_start_time - | ^ -Warning: 'my_start_time' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_external_control.mod' due to: cp_external_control.o /build/reproducible-path/cp2k-8.1/src/cp_external_control.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_files.mod machine.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'matrix_exp.o' due to: /build/reproducible-path/cp2k-8.1/src/matrix_exp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_para_types.mod cp_fm_types.mod cp_log_handling.mod mathconstants.mod cp_gemm_interface.mod message_passing.mod cp_cfm_basic_linalg.mod base_hooks.mod cp_fm_struct.mod cp_fm_basic_linalg.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/matrix_exp.F matrix_exp.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:31:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"matrix_exp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' matrix_exp.F90 -/build/reproducible-path/cp2k-8.1/src/matrix_exp.F:518:89: - - 518 | Npq%local_data(:, k) = Npq%local_data(:, k) + scaleN*Tres%local_data(:, k) - | ^ -Warning: 'REALPART_EXPR ' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'matrix_exp.mod' due to: matrix_exp.o /build/reproducible-path/cp2k-8.1/src/matrix_exp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_para_types.mod cp_fm_types.mod cp_log_handling.mod mathconstants.mod cp_gemm_interface.mod message_passing.mod cp_cfm_basic_linalg.mod base_hooks.mod cp_fm_struct.mod cp_fm_basic_linalg.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_localization_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_localization_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod cp_fm_types.mod cp_cfm_types.mod mathconstants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod cp_cfm_diag.mod kinds.mod cp_external_control.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod matrix_exp.mod cp_log_handling.mod base_hooks.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_localization_methods.F qs_localization_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:31:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_localization_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_localization_methods.F90 -/build/reproducible-path/cp2k-8.1/src/qs_localization_methods.F:1802:71: - - 1802 | ii = nblock_max*ip_has_i + i - ns_bound(ip_has_i, 1) + 1 - | ^ -Warning: 'ip_has_i' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_localization_methods.F:1374:64: - - 1374 | REAL(dp), ALLOCATABLE, DIMENSION(:, :) :: gmat, rmat_loc, rmat_recv, rmat_send, & - | ^ -Warning: 'gmat.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_localization_methods.F:1374:64: Warning: 'gmat.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_localization_methods.mod' due to: qs_localization_methods.o /build/reproducible-path/cp2k-8.1/src/qs_localization_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod cp_fm_types.mod cp_cfm_types.mod mathconstants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod cp_cfm_diag.mod kinds.mod cp_external_control.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod matrix_exp.mod cp_log_handling.mod base_hooks.mod machine.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_loc_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_loc_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod qs_loc_types.mod qs_scf_types.mod distribution_1d_types.mod block_p_types.mod cp_fm_types.mod scf_control_types.mod input_section_types.mod input_constants.mod ai_moments.mod mathconstants.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_files.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_array_utils.mod cp_fm_basic_linalg.mod message_passing.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod qs_localization_methods.mod qs_mo_methods.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_loc_utils.F qs_loc_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:31:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_utils.F90 -/build/reproducible-path/cp2k-8.1/src/qs_loc_utils.F:819:13: +note: 'maxval_container_disk' was declared here +/build/reproducible-path/cp2k-8.1/src/hfx_energy_potential.F:2122:60: - 819 | IF (jatom /= last_jatom) THEN - | ^ -Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_loc_utils.F:539:25: + 2122 | do_disk_storage) + | ^ +Warning: 'maxval_cache_disk' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/hfx_energy_potential.F:221:91: - 539 | IF (ABS(occ_imo - my_occ) > localized_wfn_control%eps_occ) THEN - | ^ -Warning: 'my_occ' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_loc_utils.mod' due to: qs_loc_utils.o /build/reproducible-path/cp2k-8.1/src/qs_loc_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod qs_loc_types.mod qs_scf_types.mod distribution_1d_types.mod block_p_types.mod cp_fm_types.mod scf_control_types.mod input_section_types.mod input_constants.mod ai_moments.mod mathconstants.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_files.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_array_utils.mod cp_fm_basic_linalg.mod message_passing.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod qs_localization_methods.mod qs_mo_methods.mod orbital_pointers.mod + 221 | TYPE(hfx_cache_type), POINTER :: maxval_cache, maxval_cache_disk + | ^ +note: 'maxval_cache_disk' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_energy_potential.mod' due to: hfx_energy_potential.o /build/reproducible-path/cp2k-8.1/src/hfx_energy_potential.F /build/reproducible-path/cp2k-8.1/src/hfx_get_pmax_val.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod gamma.mod bibliography.mod message_passing.mod hfx_contract_block.mod libint_wrapper.mod t_c_g0.mod util.mod cp_files.mod orbital_pointers.mod hfx_communication.mod hfx_pair_list_methods.mod hfx_compression_methods.mod machine.mod base_hooks.mod hfx_screening_methods.mod hfx_load_balance_methods.mod mathconstants.mod hfx_libint_interface.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_loc_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_loc_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod pw_types.mod qs_subsys_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_loc_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod string_utilities.mod cp_gemm_interface.mod mathconstants.mod cp_fm_struct.mod qs_matrix_pools.mod kinds.mod motion_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod physcon.mod qs_collocate_density.mod particle_methods.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod qs_localization_methods.mod cp_realspace_grid_cube.mod qs_loc_utils.mod machine.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_loc_methods.F qs_loc_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:32:00 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_loc_methods.mod' due to: qs_loc_methods.o /build/reproducible-path/cp2k-8.1/src/qs_loc_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod pw_types.mod qs_subsys_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_loc_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod string_utilities.mod cp_gemm_interface.mod mathconstants.mod cp_fm_struct.mod qs_matrix_pools.mod kinds.mod motion_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod physcon.mod qs_collocate_density.mod particle_methods.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod qs_localization_methods.mod cp_realspace_grid_cube.mod qs_loc_utils.mod machine.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_hash_table_functions.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_hash_table_functions.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_hash_table_functions.F qs_hash_table_functions.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:44:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_hash_table_functions.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_hash_table_functions.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_hash_table_functions.mod' due to: qs_hash_table_functions.o /build/reproducible-path/cp2k-8.1/src/qs_hash_table_functions.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_dbcsr_cholesky.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cholesky.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cholesky.F cp_dbcsr_cholesky.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:32:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_dbcsr_cholesky.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_dbcsr_cholesky.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_dbcsr_cholesky.mod' due to: cp_dbcsr_cholesky.o /build/reproducible-path/cp2k-8.1/src/cp_dbcsr_cholesky.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_types.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_nl_hash_table_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_nl_hash_table_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_hash_table_functions.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_nl_hash_table_types.F qs_nl_hash_table_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:44:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_nl_hash_table_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_nl_hash_table_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_nl_hash_table_types.mod' due to: qs_nl_hash_table_types.o /build/reproducible-path/cp2k-8.1/src/qs_nl_hash_table_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_hash_table_functions.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_ri.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_ri.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_mo_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod qs_tensors_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_loc_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod qs_ks_types.mod input_constants.mod arnoldi_api.mod cp_blacs_env.mod util.mod cp_dbcsr_diag.mod kinds.mod qs_tensors.mod qs_interactions.mod cp_array_utils.mod cp_dbcsr_operations.mod qs_loc_methods.mod qs_integral_utils.mod message_passing.mod input_cp2k_hfx.mod iterate_matrix.mod cp_dbcsr_cholesky.mod particle_methods.mod base_hooks.mod qs_loc_utils.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_ri.F hfx_ri.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:32:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_ri.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_ri.F90 -/build/reproducible-path/cp2k-8.1/src/hfx_ri.F:701:35: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod sap_kind_types.mod kpoint_types.mod qs_force_types.mod qs_oce_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_nl_hash_table_types.mod kinds.mod virial_methods.mod message_passing.mod util.mod cp_array_utils.mod qs_oce_methods.mod base_hooks.mod ao_util.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ks_atom.F qs_ks_atom.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:44:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_atom.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_atom.mod' due to: qs_ks_atom.o /build/reproducible-path/cp2k-8.1/src/qs_ks_atom.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod sap_kind_types.mod kpoint_types.mod qs_force_types.mod qs_oce_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_nl_hash_table_types.mod kinds.mod virial_methods.mod message_passing.mod util.mod cp_array_utils.mod qs_oce_methods.mod base_hooks.mod ao_util.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho0_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho0_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_rho0_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_rho_atom_types.mod cp_log_handling.mod kinds.mod orbital_transformation_matrices.mod cp_output_handling.mod qs_harmonics_atom.mod qs_grid_atom.mod memory_utilities.mod orbital_pointers.mod base_hooks.mod qs_oce_methods.mod mathconstants.mod ao_util.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho0_methods.F qs_rho0_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:45:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho0_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho0_methods.F90 +/build/reproducible-path/cp2k-8.1/src/qs_rho0_methods.F:194:74: - 701 | SUBROUTINE sort_unique_blkind_2d(blk_ind) - | ^ -Warning: 'sort_unique_blkind_2d' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/hfx_ri.F:863:70: + 194 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: cpc_ah, cpc_as + | ^ +Warning: 'cpc_as.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_rho0_methods.F:194:66: - 863 | DEALLOCATE (occupied_orbs, occupied_evals, homo_localized) - | ^ -Warning: 'occupied_orbs.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/hfx_ri.F:863:70: Warning: 'occupied_evals.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_ri.mod' due to: hfx_ri.o /build/reproducible-path/cp2k-8.1/src/hfx_ri.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_mo_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod qs_tensors_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_loc_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod qs_ks_types.mod input_constants.mod arnoldi_api.mod cp_blacs_env.mod util.mod cp_dbcsr_diag.mod kinds.mod qs_tensors.mod qs_interactions.mod cp_array_utils.mod cp_dbcsr_operations.mod qs_loc_methods.mod qs_integral_utils.mod message_passing.mod input_cp2k_hfx.mod iterate_matrix.mod cp_dbcsr_cholesky.mod particle_methods.mod base_hooks.mod qs_loc_utils.mod machine.mod + 194 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: cpc_ah, cpc_as + | ^ +Warning: 'cpc_ah.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho0_methods.mod' due to: qs_rho0_methods.o /build/reproducible-path/cp2k-8.1/src/qs_rho0_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_rho0_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_rho_atom_types.mod cp_log_handling.mod kinds.mod orbital_transformation_matrices.mod cp_output_handling.mod qs_harmonics_atom.mod qs_grid_atom.mod memory_utilities.mod orbital_pointers.mod base_hooks.mod qs_oce_methods.mod mathconstants.mod ao_util.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_adiabatic_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/xc_adiabatic_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_mo_types.mod qs_energy_types.mod input_constants.mod base_hooks.mod mathconstants.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc_adiabatic_methods.F xc_adiabatic_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:32:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc_adiabatic_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_adiabatic_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_adiabatic_methods.mod' due to: xc_adiabatic_methods.o /build/reproducible-path/cp2k-8.1/src/xc_adiabatic_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_mo_types.mod qs_energy_types.mod input_constants.mod base_hooks.mod mathconstants.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_integrate_potential_product.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential_product.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod qs_force_types.mod admm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod task_list_types.mod realspace_grid_types.mod kinds.mod cube_utils.mod task_list_methods.mod rs_pw_interface.mod base_hooks.mod gaussian_gridlevels.mod input_constants.mod grid_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential_product.F qs_integrate_potential_product.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:45:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_integrate_potential_product.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_integrate_potential_product.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_integrate_potential_product.mod' due to: qs_integrate_potential_product.o /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential_product.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod qs_force_types.mod admm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod task_list_types.mod realspace_grid_types.mod kinds.mod cube_utils.mod task_list_methods.mod rs_pw_interface.mod base_hooks.mod gaussian_gridlevels.mod input_constants.mod grid_api.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_adiabatic_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/xc_adiabatic_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cp_para_types.mod input_section_types.mod pw_types.mod qs_environment_types.mod cp_control_types.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod hfx_communication.mod base_hooks.mod hfx_derivatives.mod qs_vxc.mod xc_adiabatic_methods.mod qs_vxc_atom.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc_adiabatic_utils.F xc_adiabatic_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:32:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc_adiabatic_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_adiabatic_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_adiabatic_utils.mod' due to: xc_adiabatic_utils.o /build/reproducible-path/cp2k-8.1/src/xc_adiabatic_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cp_para_types.mod input_section_types.mod pw_types.mod qs_environment_types.mod cp_control_types.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod hfx_communication.mod base_hooks.mod hfx_derivatives.mod qs_vxc.mod xc_adiabatic_methods.mod qs_vxc_atom.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_integrate_potential_single.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential_single.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_force_types.mod atprop_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod external_potential_types.mod pw_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod lri_environment_types.mod realspace_grid_types.mod kinds.mod message_passing.mod memory_utilities.mod orbital_pointers.mod rs_pw_interface.mod base_hooks.mod gaussian_gridlevels.mod ao_util.mod grid_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential_single.F qs_integrate_potential_single.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:45:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_integrate_potential_single.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_integrate_potential_single.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_integrate_potential_single.mod' due to: qs_integrate_potential_single.o /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential_single.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_force_types.mod atprop_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod external_potential_types.mod pw_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod lri_environment_types.mod realspace_grid_types.mod kinds.mod message_passing.mod memory_utilities.mod orbital_pointers.mod rs_pw_interface.mod base_hooks.mod gaussian_gridlevels.mod ao_util.mod grid_api.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_pw_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_pw_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod pw_grid_types.mod input_constants.mod pw_methods.mod mathconstants.mod kinds.mod pw_poisson_methods.mod cp_output_handling.mod cp_dbcsr_operations.mod qs_collocate_density.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_pw_methods.F hfx_pw_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:32:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_pw_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_pw_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_pw_methods.mod' due to: hfx_pw_methods.o /build/reproducible-path/cp2k-8.1/src/hfx_pw_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod pw_grid_types.mod input_constants.mod pw_methods.mod mathconstants.mod kinds.mod pw_poisson_methods.mod cp_output_handling.mod cp_dbcsr_operations.mod qs_collocate_density.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_integrate_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod qs_integrate_potential_product.mod qs_integrate_potential_single.mod grid_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential.F qs_integrate_potential.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:45:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_integrate_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_integrate_potential.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_integrate_potential.mod' due to: qs_integrate_potential.o /build/reproducible-path/cp2k-8.1/src/qs_integrate_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod qs_integrate_potential_product.mod qs_integrate_potential_single.mod grid_api.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho0_ggrid.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho0_ggrid.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod qs_rho0_types.mod pw_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod qs_rho_atom_types.mod realspace_grid_types.mod kinds.mod orbital_transformation_matrices.mod qs_integrate_potential.mod qs_harmonics_atom.mod cube_utils.mod message_passing.mod memory_utilities.mod util.mod orbital_pointers.mod pw_methods.mod base_hooks.mod gaussian_gridlevels.mod mathconstants.mod grid_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho0_ggrid.F qs_rho0_ggrid.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:46:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho0_ggrid.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho0_ggrid.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho0_ggrid.mod' due to: qs_rho0_ggrid.o /build/reproducible-path/cp2k-8.1/src/qs_rho0_ggrid.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod qs_rho0_types.mod pw_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod qs_rho_atom_types.mod realspace_grid_types.mod kinds.mod orbital_transformation_matrices.mod qs_integrate_potential.mod qs_harmonics_atom.mod cube_utils.mod message_passing.mod memory_utilities.mod util.mod orbital_pointers.mod pw_methods.mod base_hooks.mod gaussian_gridlevels.mod mathconstants.mod grid_api.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_gapw_densities.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_gapw_densities.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_rho0_types.mod cp_control_types.mod qs_kind_types.mod qs_rho_atom_types.mod qs_charges_types.mod qs_local_rho_types.mod atomic_kind_types.mod message_passing.mod cp_log_handling.mod qs_rho_atom_methods.mod kinds.mod qs_rho0_methods.mod base_hooks.mod qs_rho0_ggrid.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_gapw_densities.F qs_gapw_densities.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:46:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gapw_densities.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gapw_densities.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_gapw_densities.mod' due to: qs_gapw_densities.o /build/reproducible-path/cp2k-8.1/src/qs_gapw_densities.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_rho0_types.mod cp_control_types.mod qs_kind_types.mod qs_rho_atom_types.mod qs_charges_types.mod qs_local_rho_types.mod atomic_kind_types.mod message_passing.mod cp_log_handling.mod qs_rho_atom_methods.mod kinds.mod qs_rho0_methods.mod base_hooks.mod qs_rho0_ggrid.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'admm_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/admm_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_mo_types.mod qs_rho_types.mod admm_types.mod molecule_types.mod qs_oce_types.mod cp_fm_types.mod qs_local_rho_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod task_list_types.mod qs_vxc_atom.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod qs_ks_atom.mod bibliography.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod cp_dbcsr_output.mod cp_fm_cholesky.mod task_list_methods.mod qs_collocate_density.mod qs_vxc.mod cp_fm_basic_linalg.mod qs_rho_atom_methods.mod qs_gapw_densities.mod base_hooks.mod qs_oce_methods.mod cp_fm_diag.mod qs_overlap.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/admm_methods.F admm_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:46:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'admm_methods.mod' due to: admm_methods.o /build/reproducible-path/cp2k-8.1/src/admm_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_mo_types.mod qs_rho_types.mod admm_types.mod molecule_types.mod qs_oce_types.mod cp_fm_types.mod qs_local_rho_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod task_list_types.mod qs_vxc_atom.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod qs_ks_atom.mod bibliography.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod cp_dbcsr_output.mod cp_fm_cholesky.mod task_list_methods.mod qs_collocate_density.mod qs_vxc.mod cp_fm_basic_linalg.mod qs_rho_atom_methods.mod qs_gapw_densities.mod base_hooks.mod qs_oce_methods.mod cp_fm_diag.mod qs_overlap.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_admm_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_admm_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod admm_types.mod pw_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod admm_dm_types.mod cp_para_types.mod virial_types.mod rt_propagation_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod basis_set_container_types.mod qs_local_rho_types.mod pw_poisson_types.mod pw_pool_types.mod hfx_types.mod external_potential_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod qs_energy_types.mod admm_methods.mod input_constants.mod qs_rho_atom_methods.mod hfx_derivatives.mod kinds.mod hfx_energy_potential.mod qs_interactions.mod cp_log_handling.mod hfx_ri.mod xc_adiabatic_utils.mod base_hooks.mod hfx_pw_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hfx_admm_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/hfx_admm_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod pw_pool_types.mod admm_dm_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod pw_poisson_types.mod rt_propagation_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod external_potential_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_control_types.mod basis_set_container_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod xc_adiabatic_utils.mod qs_interactions.mod hfx_derivatives.mod qs_rho_atom_methods.mod hfx_ri.mod base_hooks.mod input_constants.mod hfx_pw_methods.mod hfx_energy_potential.mod admm_methods.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hfx_admm_utils.F hfx_admm_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:32:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_admm_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_admm_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:46:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hfx_admm_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hfx_admm_utils.F90 /build/reproducible-path/cp2k-8.1/src/hfx_admm_utils.F:1214:25: 1214 | energy%ex = ehfx @@ -42743,118 +43062,258 @@ 550 | energy%ex = ehfx + ehfxrt | ^ Warning: 'ehfxrt' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_admm_utils.mod' due to: hfx_admm_utils.o /build/reproducible-path/cp2k-8.1/src/hfx_admm_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod admm_types.mod pw_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod admm_dm_types.mod cp_para_types.mod virial_types.mod rt_propagation_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod basis_set_container_types.mod qs_local_rho_types.mod pw_poisson_types.mod pw_pool_types.mod hfx_types.mod external_potential_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod qs_energy_types.mod admm_methods.mod input_constants.mod qs_rho_atom_methods.mod hfx_derivatives.mod kinds.mod hfx_energy_potential.mod qs_interactions.mod cp_log_handling.mod hfx_ri.mod xc_adiabatic_utils.mod base_hooks.mod hfx_pw_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_overlap3_debug.mod' due to: ai_overlap3_debug.o +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hfx_admm_utils.mod' due to: hfx_admm_utils.o /build/reproducible-path/cp2k-8.1/src/hfx_admm_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod pw_pool_types.mod admm_dm_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod pw_poisson_types.mod rt_propagation_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod external_potential_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_control_types.mod basis_set_container_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod xc_adiabatic_utils.mod qs_interactions.mod hfx_derivatives.mod qs_rho_atom_methods.mod hfx_ri.mod base_hooks.mod input_constants.mod hfx_pw_methods.mod hfx_energy_potential.mod admm_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_overlap3.mod' due to: ai_overlap3.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_charge_mixing.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_charge_mixing.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_density_mixing_types.mod mathlib.mod message_passing.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_charge_mixing.F qs_charge_mixing.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:46:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_charge_mixing.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_charge_mixing.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_charge_mixing.mod' due to: qs_charge_mixing.o /build/reproducible-path/cp2k-8.1/src/qs_charge_mixing.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_density_mixing_types.mod mathlib.mod message_passing.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_overlap_aabb.mod' due to: ai_overlap_aabb.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_condnum.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_condnum.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod mathlib.mod kinds.mod cp_fm_diag.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod arnoldi_api.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_condnum.F qs_condnum.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:46:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_condnum.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_condnum.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_condnum.mod' due to: qs_condnum.o /build/reproducible-path/cp2k-8.1/src/qs_condnum.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod mathlib.mod kinds.mod cp_fm_diag.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod arnoldi_api.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'debug_os_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/debug_os_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ai_overlap_debug.mod ai_overlap.mod base_hooks.mod ai_overlap3_debug.mod orbital_pointers.mod ai_overlap3.mod kinds.mod ai_overlap_aabb.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/debug_os_integrals.F debug_os_integrals.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:32:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"debug_os_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' debug_os_integrals.F90 -/build/reproducible-path/cp2k-8.1/src/debug_os_integrals.F:46:36: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dispersion_pairpot.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod cp_parser_types.mod qs_force_types.mod atprop_types.mod molecule_types.mod qs_dispersion_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod bibliography.mod virial_methods.mod message_passing.mod memory_utilities.mod cp_files.mod base_hooks.mod mathconstants.mod input_constants.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F qs_dispersion_pairpot.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:46:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dispersion_pairpot.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dispersion_pairpot.F90 +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1599:33: - 46 | SUBROUTINE overlap_ab_test_simple() - | ^ -Warning: 'overlap_ab_test_simple' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/debug_os_integrals.F:191:37: + 1599 | e8tot = e8tot - e8 + | ^ +Warning: 'e8' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1598:33: - 191 | SUBROUTINE overlap_abc_test_simple() - | ^ -Warning: 'overlap_abc_test_simple' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/debug_os_integrals.F:386:38: + 1598 | e6tot = e6tot - e6 + | ^ +Warning: 'e6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1617:53: - 386 | SUBROUTINE overlap_aabb_test_simple() - | ^ -Warning: 'overlap_aabb_test_simple' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'debug_os_integrals.mod' due to: debug_os_integrals.o /build/reproducible-path/cp2k-8.1/src/debug_os_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ai_overlap_debug.mod ai_overlap.mod base_hooks.mod ai_overlap3_debug.mod orbital_pointers.mod ai_overlap3.mod kinds.mod ai_overlap_aabb.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_operators_r12.mod' due to: ai_operators_r12.o + 1617 | fdij(:) = (de6 + de8)*rij(:)/dr*fac + | ^ +Warning: 'de8' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1617:53: Warning: 'de6' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1789:117: + + 1789 | force(jkind)%dispersion(:, atom_b) = force(jkind)%dispersion(:, atom_b) + fdij(:) + | ^ +Warning: 'atom_b' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1788:117: + + 1788 | force(ikind)%dispersion(:, atom_a) = force(ikind)%dispersion(:, atom_a) - fdij(:) + | ^ +Warning: 'atom_a' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:2000:111: + + 2000 | elrc9 = elrc9 - s9*64._dp*twopi*REAL(na*nb*nc, KIND=dp)*c9/(6._dp*rcut**3*cell%deth**2) + | ^ +Warning: 's9' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1639:27: + + 1639 | ELSE IF (idmp == 2) THEN + | ^ +Warning: 'idmp' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:2102:10: + + 2102 | IF (domol) THEN + | ^ +Warning: 'domol' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1545:83: + + 1545 | CALL virial_pair_force(atstr(:, :, iatom), -0.5_dp, fdij, rij) + | ^ +Warning: 'atstr.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1545:83: Warning: 'atstr.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1819:101: + + 1819 | CALL virial_pair_force(atstr(:, :, katom), -0.5_dp, fdij, rca) + | ^ +Warning: 'atstr.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: + + 1219 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: atstr + | ^ +Warning: 'atstr.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: Warning: 'atstr.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: Warning: 'atstr.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: Warning: 'atstr.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1219:65: Warning: 'atstr.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1545:83: + + 1545 | CALL virial_pair_force(atstr(:, :, iatom), -0.5_dp, fdij, rij) + | ^ +Warning: 'atstr.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1550:68: + + 1550 | atener(iatom) = atener(iatom) - 0.5_dp*xp*fdmp*fac + | ^ +Warning: 'atener.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1550:68: Warning: 'atener.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F:1550:68: Warning: 'atener.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dispersion_pairpot.mod' due to: qs_dispersion_pairpot.o /build/reproducible-path/cp2k-8.1/src/qs_dispersion_pairpot.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod cp_parser_types.mod qs_force_types.mod atprop_types.mod molecule_types.mod qs_dispersion_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod bibliography.mod virial_methods.mod message_passing.mod memory_utilities.mod cp_files.mod base_hooks.mod mathconstants.mod input_constants.mod cp_parser_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_operator_ra2m.mod' due to: ai_operator_ra2m.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xtb_coulomb.o' due to: /build/reproducible-path/cp2k-8.1/src/xtb_coulomb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod sap_kind_types.mod kpoint_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod pw_poisson_types.mod atprop_types.mod xtb_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod distribution_1d_types.mod virial_types.mod ewald_pw_types.mod cp_control_types.mod qs_energy_types.mod ewald_methods_tb.mod kinds.mod qs_dftb3_methods.mod ai_overlap.mod virial_methods.mod message_passing.mod qs_integral_utils.mod ai_contraction.mod orbital_pointers.mod base_hooks.mod qmmm_tb_coulomb.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xtb_coulomb.F xtb_coulomb.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:47:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_coulomb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_coulomb.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xtb_coulomb.mod' due to: xtb_coulomb.o /build/reproducible-path/cp2k-8.1/src/xtb_coulomb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod sap_kind_types.mod kpoint_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod pw_poisson_types.mod atprop_types.mod xtb_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod distribution_1d_types.mod virial_types.mod ewald_pw_types.mod cp_control_types.mod qs_energy_types.mod ewald_methods_tb.mod kinds.mod qs_dftb3_methods.mod ai_overlap.mod virial_methods.mod message_passing.mod qs_integral_utils.mod ai_contraction.mod orbital_pointers.mod base_hooks.mod qmmm_tb_coulomb.mod mathconstants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'generic_os_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/generic_os_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod ai_contraction_sphi.mod debug_os_integrals.mod ai_overlap.mod base_hooks.mod ai_operators_r12.mod ai_operator_ra2m.mod constants_operator.mod ai_overlap_aabb.mod orbital_pointers.mod kinds.mod ai_derivatives.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/generic_os_integrals.F generic_os_integrals.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:32:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"generic_os_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' generic_os_integrals.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'generic_os_integrals.mod' due to: generic_os_integrals.o /build/reproducible-path/cp2k-8.1/src/generic_os_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod ai_contraction_sphi.mod debug_os_integrals.mod ai_overlap.mod base_hooks.mod ai_operators_r12.mod ai_operator_ra2m.mod constants_operator.mod ai_overlap_aabb.mod orbital_pointers.mod kinds.mod ai_derivatives.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xtb_matrices.o' due to: /build/reproducible-path/cp2k-8.1/src/xtb_matrices.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod atprop_types.mod qs_dispersion_types.mod xtb_types.mod block_p_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod pair_potential_types.mod cp_control_types.mod qs_energy_types.mod efield_tb_methods.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod ai_overlap.mod pair_potential_util.mod virial_methods.mod cp_dbcsr_operations.mod message_passing.mod mulliken.mod qs_integral_utils.mod cp_dbcsr_output.mod qs_charge_mixing.mod string_utilities.mod ai_contraction.mod qs_condnum.mod xtb_parameters.mod orbital_pointers.mod cp_blacs_env.mod qs_dispersion_pairpot.mod base_hooks.mod fparser.mod qs_overlap.mod xtb_coulomb.mod pair_potential.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xtb_matrices.F xtb_matrices.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:47:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_matrices.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_matrices.F90 +/build/reproducible-path/cp2k-8.1/src/xtb_matrices.F:1466:22: + + 1466 | IF (iw > 0) WRITE (iw, *) "TESTING ", TRIM(name_atm_a), TRIM(name_atm_b), & + | ^ +Warning: 'iw' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xtb_matrices.F:1442:75: + + 1442 | INTEGER :: ikind, ingp, iw, jkind + | ^ +note: 'iw' was declared here +/build/reproducible-path/cp2k-8.1/src/xtb_matrices.F:1517:94: + + 1517 | SUBROUTINE xb_interaction(exb, neighbor_atoms, atom_of_kind, kind_of, sab_xb, kx, kx2, rcab, & + | ^ +Warning: 'rcab.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xtb_matrices.F:161:95: + + 161 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :) :: dfblock, huckel, kcnlk, owork, rcab + | ^ +note: 'rcab.dim[1].stride' was declared here +/build/reproducible-path/cp2k-8.1/src/xtb_matrices.F:1399:19: + + 1399 | IF (use_virial) THEN + | ^ +Warning: 'use_virial' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xtb_matrices.F:154:46: + + 154 | omit_headers, use_arnoldi, use_virial, xb_inter + | ^ +note: 'use_virial' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xtb_matrices.mod' due to: xtb_matrices.o /build/reproducible-path/cp2k-8.1/src/xtb_matrices.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod atprop_types.mod qs_dispersion_types.mod xtb_types.mod block_p_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod pair_potential_types.mod cp_control_types.mod qs_energy_types.mod efield_tb_methods.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod ai_overlap.mod pair_potential_util.mod virial_methods.mod cp_dbcsr_operations.mod message_passing.mod mulliken.mod qs_integral_utils.mod cp_dbcsr_output.mod qs_charge_mixing.mod string_utilities.mod ai_contraction.mod qs_condnum.mod xtb_parameters.mod orbital_pointers.mod cp_blacs_env.mod qs_dispersion_pairpot.mod base_hooks.mod fparser.mod qs_overlap.mod xtb_coulomb.mod pair_potential.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod basis_set_types.mod base_hooks.mod generic_os_integrals.mod generic_shg_integrals.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_integrals.F lri_integrals.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:32:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_integrals.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_integrals.mod' due to: lri_integrals.o /build/reproducible-path/cp2k-8.1/src/lri_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod basis_set_types.mod base_hooks.mod generic_os_integrals.mod generic_shg_integrals.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 's_square_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/s_square_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_mo_types.mod cp_control_types.mod cp_fm_types.mod message_passing.mod kinds.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/s_square_methods.F s_square_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:47:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"s_square_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' s_square_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 's_square_methods.mod' due to: s_square_methods.o /build/reproducible-path/cp2k-8.1/src/s_square_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_mo_types.mod cp_control_types.mod cp_fm_types.mod message_passing.mod kinds.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_forces.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_forces.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod basis_set_types.mod atomic_kind_types.mod qs_o3c_types.mod virial_types.mod qs_force_types.mod qs_neighbor_list_types.mod qs_environment_types.mod qs_ks_types.mod kpoint_types.mod virial_methods.mod base_hooks.mod lri_integrals.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_forces.F lri_forces.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:33:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_forces.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_forces.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_forces.mod' due to: lri_forces.o /build/reproducible-path/cp2k-8.1/src/lri_forces.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod basis_set_types.mod atomic_kind_types.mod qs_o3c_types.mod virial_types.mod qs_force_types.mod qs_neighbor_list_types.mod qs_environment_types.mod qs_ks_types.mod kpoint_types.mod virial_methods.mod base_hooks.mod lri_integrals.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hirshfeld_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hirshfeld_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod hirshfeld_types.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod realspace_grid_types.mod kinds.mod grid_api.mod periodic_table.mod cube_utils.mod message_passing.mod pw_methods.mod base_hooks.mod mathconstants.mod ao_util.mod input_constants.mod atom_kind_orbitals.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hirshfeld_methods.F hirshfeld_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:47:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hirshfeld_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hirshfeld_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hirshfeld_methods.mod' due to: hirshfeld_methods.o /build/reproducible-path/cp2k-8.1/src/hirshfeld_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod hirshfeld_types.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod realspace_grid_types.mod kinds.mod grid_api.mod periodic_table.mod cube_utils.mod message_passing.mod pw_methods.mod base_hooks.mod mathconstants.mod ao_util.mod input_constants.mod atom_kind_orbitals.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_overlap_ppl.mod' due to: ai_overlap_ppl.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_image_charge.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_image_charge.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod pw_pool_types.mod cell_types.mod pw_poisson_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod qs_integrate_potential.mod cp_output_handling.mod message_passing.mod pw_poisson_methods.mod qs_collocate_density.mod memory_utilities.mod util.mod cp_eri_mme_interface.mod cp_files.mod pw_methods.mod eri_mme_integrate.mod base_hooks.mod mathconstants.mod ao_util.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_image_charge.F qmmm_image_charge.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:47:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_image_charge.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_image_charge.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_image_charge.mod' due to: qmmm_image_charge.o /build/reproducible-path/cp2k-8.1/src/qmmm_image_charge.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod pw_pool_types.mod cell_types.mod pw_poisson_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod qs_integrate_potential.mod cp_output_handling.mod message_passing.mod pw_poisson_methods.mod qs_collocate_density.mod memory_utilities.mod util.mod cp_eri_mme_interface.mod cp_files.mod pw_methods.mod eri_mme_integrate.mod base_hooks.mod mathconstants.mod ao_util.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'core_ppl.o' due to: /build/reproducible-path/cp2k-8.1/src/core_ppl.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod external_potential_types.mod qs_neighbor_list_types.mod ai_overlap_ppl.mod base_hooks.mod virial_methods.mod orbital_pointers.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/core_ppl.F core_ppl.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:33:16 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"core_ppl.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' core_ppl.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'core_ppl.mod' due to: core_ppl.o /build/reproducible-path/cp2k-8.1/src/core_ppl.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod external_potential_types.mod qs_neighbor_list_types.mod ai_overlap_ppl.mod base_hooks.mod virial_methods.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_output.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_output.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod scf_control_types.mod particle_types.mod qs_cdft_types.mod qs_charges_types.mod qs_rho_types.mod qs_mo_types.mod pw_poisson_types.mod ps_implicit_types.mod qs_scf_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_cdft_opt_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod kahan_sum.mod qmmm_image_charge.mod qs_mo_methods.mod cp_dbcsr_output.mod machine.mod base_hooks.mod qs_mo_io.mod input_constants.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_output.F qs_scf_output.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:47:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_output.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_output.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_output.mod' due to: qs_scf_output.o /build/reproducible-path/cp2k-8.1/src/qs_scf_output.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod scf_control_types.mod particle_types.mod qs_cdft_types.mod qs_charges_types.mod qs_rho_types.mod qs_mo_types.mod pw_poisson_types.mod ps_implicit_types.mod qs_scf_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_cdft_opt_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod kahan_sum.mod qmmm_image_charge.mod qs_mo_methods.mod cp_dbcsr_output.mod machine.mod base_hooks.mod qs_mo_io.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_compression.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_compression.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_compression.F lri_compression.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:33:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_compression.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_compression.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_compression.mod' due to: lri_compression.o /build/reproducible-path/cp2k-8.1/src/lri_compression.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_cdft_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_cdft_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod hirshfeld_types.mod particle_types.mod cell_types.mod qs_cdft_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod outer_scf_control_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod grid_api.mod cp_output_handling.mod bibliography.mod cp_realspace_grid_cube.mod hirshfeld_methods.mod memory_utilities.mod qs_scf_output.mod base_hooks.mod ao_util.mod input_constants.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_cdft_utils.F qs_cdft_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:47:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_utils.F90 +/build/reproducible-path/cp2k-8.1/src/qs_cdft_utils.F:925:54: + + 925 | nzeroed_inner = nzeroed_inner + 1 + | ^ +Warning: 'nzeroed_inner' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_cdft_utils.F:935:48: + + 935 | nzeroed = nzeroed + nzeroed_inner + | ^ +Warning: 'nzeroed' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_cdft_utils.mod' due to: qs_cdft_utils.o /build/reproducible-path/cp2k-8.1/src/qs_cdft_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod hirshfeld_types.mod particle_types.mod cell_types.mod qs_cdft_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod outer_scf_control_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod grid_api.mod cp_output_handling.mod bibliography.mod cp_realspace_grid_cube.mod hirshfeld_methods.mod memory_utilities.mod qs_scf_output.mod base_hooks.mod ao_util.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_environment_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_environment_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod lri_environment_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod input_constants.mod kinds.mod cp_output_handling.mod core_ppl.mod message_passing.mod qs_collocate_density.mod lri_integrals.mod mathlib.mod cp_log_handling.mod base_hooks.mod generic_os_integrals.mod lri_compression.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_environment_methods.F lri_environment_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:33:32 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_environment_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_environment_methods.F90 -/build/reproducible-path/cp2k-8.1/src/lri_environment_methods.F:481:40: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_cdft_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod hirshfeld_types.mod particle_types.mod cell_types.mod qs_cdft_types.mod qs_force_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod qs_rho0_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod qs_energy_types.mod realspace_grid_types.mod cp_log_handling.mod qs_cdft_utils.mod kinds.mod cp_output_handling.mod cube_utils.mod message_passing.mod kahan_sum.mod cp_realspace_grid_cube.mod pw_methods.mod base_hooks.mod ao_util.mod input_constants.mod grid_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F qs_cdft_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:48:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_methods.F90 +/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:916:122: - 481 | SUBROUTINE calculate_lri_overlap_aabb(lri_env, qs_env) - | ^ -Warning: 'calculate_lri_overlap_aabb' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/lri_environment_methods.F:399:65: + 916 | gapw_offset(igroup, i) = gapw_offset(igroup, i) + sign*group(igroup)%coeff(iatom)*mp_rho(jatom)%q0(i) + | ^ +Warning: 'sign' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:791:66: - 399 | nspin - | ^ -Warning: 'nspin' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_environment_methods.mod' due to: lri_environment_methods.o /build/reproducible-path/cp2k-8.1/src/lri_environment_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod lri_environment_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod input_constants.mod kinds.mod cp_output_handling.mod core_ppl.mod message_passing.mod qs_collocate_density.mod lri_integrals.mod mathlib.mod cp_log_handling.mod base_hooks.mod generic_os_integrals.mod lri_compression.mod + 791 | TYPE(pw_p_type), DIMENSION(:), POINTER :: charge, rho_r + | ^ +Warning: 'charge.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:791:66: Warning: 'charge.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:161:68: + + 161 | REAL(kind=dp), ALLOCATABLE, DIMENSION(:, :, :) :: dP_i_dRj + | ^ +Warning: 'dp_i_drj.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:161:68: Warning: 'dp_i_drj.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:315:35: + + 315 | dP_i_dRi = 0.0_dp + | ^ +Warning: 'dp_i_dri.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:311:38: + + 311 | d_sum_Pm_dR = 0.0_dp + | ^ +Warning: 'd_sum_pm_dr.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:154:73: + + 154 | LOGICAL, ALLOCATABLE, DIMENSION(:, :) :: atom_in_group + | ^ +Warning: 'atom_in_group.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:154:73: Warning: 'atom_in_group.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:471:115: + + 471 | group(igroup)%coeff(ip)*dP_i_dRi(:, iatom) + | ^ +Warning: 'ip' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:172:66: + + 172 | TYPE(pw_p_type), DIMENSION(:), POINTER :: charge + | ^ +Warning: 'charge.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:172:66: Warning: 'charge.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:724:98: + + 724 | rho_r(ispin)%pw%cr3d(k, j, i)*dvol + | ^ +Warning: 'sign' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_cdft_methods.mod' due to: qs_cdft_methods.o /build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod hirshfeld_types.mod particle_types.mod cell_types.mod qs_cdft_types.mod qs_force_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod qs_rho0_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod qs_energy_types.mod realspace_grid_types.mod cp_log_handling.mod qs_cdft_utils.mod kinds.mod cp_output_handling.mod cube_utils.mod message_passing.mod kahan_sum.mod cp_realspace_grid_cube.mod pw_methods.mod base_hooks.mod ao_util.mod input_constants.mod grid_api.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_apply_restraints.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_apply_restraints.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_cdft_types.mod qs_rho_types.mod qs_mo_types.mod cp_fm_types.mod qs_environment_types.mod pw_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod s_square_methods.mod cp_dbcsr_operations.mod mulliken.mod pw_methods.mod base_hooks.mod input_constants.mod qs_cdft_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ks_apply_restraints.F qs_ks_apply_restraints.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:48:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_apply_restraints.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_apply_restraints.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_apply_restraints.mod' due to: qs_ks_apply_restraints.o /build/reproducible-path/cp2k-8.1/src/qs_ks_apply_restraints.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_cdft_types.mod qs_rho_types.mod qs_mo_types.mod cp_fm_types.mod qs_environment_types.mod pw_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod s_square_methods.mod cp_dbcsr_operations.mod mulliken.mod pw_methods.mod base_hooks.mod input_constants.mod qs_cdft_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_ddapc_forces.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_ddapc_forces.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_control_types.mod cp_para_types.mod input_section_types.mod pw_types.mod qs_force_types.mod qs_environment_types.mod cell_types.mod particle_types.mod input_constants.mod spherical_harmonics.mod mathconstants.mod message_passing.mod base_hooks.mod pw_spline_utils.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_ks_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_ks_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_o3c_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod lri_environment_types.mod kinds.mod base_hooks.mod qs_o3c_methods.mod lri_compression.mod ri_environment_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_ks_methods.F lri_ks_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:48:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_ks_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_ks_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_ks_methods.mod' due to: lri_ks_methods.o /build/reproducible-path/cp2k-8.1/src/lri_ks_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_o3c_types.mod qs_neighbor_list_types.mod atomic_kind_types.mod lri_environment_types.mod kinds.mod base_hooks.mod qs_o3c_methods.mod lri_compression.mod ri_environment_methods.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_ddapc_forces.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_ddapc_forces.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_control_types.mod pw_types.mod particle_types.mod cell_types.mod qs_force_types.mod input_section_types.mod atomic_kind_types.mod message_passing.mod mathconstants.mod kinds.mod base_hooks.mod input_constants.mod spherical_harmonics.mod pw_spline_utils.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_ddapc_forces.F cp_ddapc_forces.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:33:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc_forces.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc_forces.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_ddapc_forces.mod' due to: cp_ddapc_forces.o /build/reproducible-path/cp2k-8.1/src/cp_ddapc_forces.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_control_types.mod cp_para_types.mod input_section_types.mod pw_types.mod qs_force_types.mod qs_environment_types.mod cell_types.mod particle_types.mod input_constants.mod spherical_harmonics.mod mathconstants.mod message_passing.mod base_hooks.mod pw_spline_utils.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:48:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc_forces.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc_forces.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_ddapc_forces.mod' due to: cp_ddapc_forces.o /build/reproducible-path/cp2k-8.1/src/cp_ddapc_forces.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_control_types.mod pw_types.mod particle_types.mod cell_types.mod qs_force_types.mod input_section_types.mod atomic_kind_types.mod message_passing.mod mathconstants.mod kinds.mod base_hooks.mod input_constants.mod spherical_harmonics.mod pw_spline_utils.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_ddapc_util.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_ddapc_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod cp_ddapc_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod qs_charges_types.mod input_section_types.mod input_constants.mod pw_methods.mod mathconstants.mod cp_ddapc_forces.mod kinds.mod atomic_charges.mod cp_ddapc_methods.mod cp_output_handling.mod message_passing.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_ddapc_util.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_ddapc_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_charges_types.mod qs_rho_types.mod cp_ddapc_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod atomic_charges.mod cp_output_handling.mod message_passing.mod cp_ddapc_forces.mod cp_ddapc_methods.mod pw_methods.mod base_hooks.mod mathconstants.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_ddapc_util.F cp_ddapc_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:33:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_ddapc_util.mod' due to: cp_ddapc_util.o /build/reproducible-path/cp2k-8.1/src/cp_ddapc_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod cp_ddapc_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod qs_charges_types.mod input_section_types.mod input_constants.mod pw_methods.mod mathconstants.mod cp_ddapc_forces.mod kinds.mod atomic_charges.mod cp_ddapc_methods.mod cp_output_handling.mod message_passing.mod cp_log_handling.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:48:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_ddapc_util.mod' due to: cp_ddapc_util.o /build/reproducible-path/cp2k-8.1/src/cp_ddapc_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_charges_types.mod qs_rho_types.mod cp_ddapc_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod atomic_charges.mod cp_output_handling.mod message_passing.mod cp_ddapc_forces.mod cp_ddapc_methods.mod pw_methods.mod base_hooks.mod mathconstants.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_ddapc.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_ddapc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod input_section_types.mod qs_energy_types.mod input_constants.mod pw_methods.mod cp_ddapc_forces.mod kinds.mod qs_integrate_potential.mod cp_ddapc_util.mod cp_output_handling.mod bibliography.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_ddapc.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_ddapc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod cell_types.mod qs_environment_types.mod pw_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod qs_integrate_potential.mod cp_output_handling.mod bibliography.mod cp_ddapc_util.mod cp_ddapc_forces.mod pw_methods.mod base_hooks.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_ddapc.F cp_ddapc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:34:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_ddapc.mod' due to: cp_ddapc.o /build/reproducible-path/cp2k-8.1/src/cp_ddapc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod input_section_types.mod qs_energy_types.mod input_constants.mod pw_methods.mod cp_ddapc_forces.mod kinds.mod qs_integrate_potential.mod cp_ddapc_util.mod cp_output_handling.mod bibliography.mod cp_log_handling.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_o3c_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_o3c_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_o3c_types.mod ai_contraction_sphi.mod base_hooks.mod orbital_pointers.mod ai_overlap3.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_o3c_methods.F qs_o3c_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:34:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_o3c_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_o3c_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_o3c_methods.mod' due to: qs_o3c_methods.o /build/reproducible-path/cp2k-8.1/src/qs_o3c_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_o3c_types.mod ai_contraction_sphi.mod base_hooks.mod orbital_pointers.mod ai_overlap3.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:48:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_ddapc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_ddapc.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_ddapc.mod' due to: cp_ddapc.o /build/reproducible-path/cp2k-8.1/src/cp_ddapc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod cell_types.mod qs_environment_types.mod pw_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod qs_integrate_potential.mod cp_output_handling.mod bibliography.mod cp_ddapc_util.mod cp_ddapc_forces.mod pw_methods.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ri_environment_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/ri_environment_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod lri_environment_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_o3c_types.mod atomic_kind_types.mod qs_ks_types.mod arnoldi_api.mod cp_blacs_env.mod util.mod cp_dbcsr_diag.mod kinds.mod qs_o3c_methods.mod cp_dbcsr_operations.mod message_passing.mod iterate_matrix.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ri_environment_methods.F ri_environment_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:34:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ri_environment_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ri_environment_methods.F90 -/build/reproducible-path/cp2k-8.1/src/ri_environment_methods.F:626:23: - - 626 | IF (symm .AND. (iatom /= jatom)) THEN - | ^ -Warning: 'symm' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ri_environment_methods.mod' due to: ri_environment_methods.o /build/reproducible-path/cp2k-8.1/src/ri_environment_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod lri_environment_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_o3c_types.mod atomic_kind_types.mod qs_ks_types.mod arnoldi_api.mod cp_blacs_env.mod util.mod cp_dbcsr_diag.mod kinds.mod qs_o3c_methods.mod cp_dbcsr_operations.mod message_passing.mod iterate_matrix.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_ks_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_ks_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod atomic_kind_types.mod qs_o3c_types.mod qs_neighbor_list_types.mod ri_environment_methods.mod base_hooks.mod qs_o3c_methods.mod lri_compression.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_ks_methods.F lri_ks_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:34:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_ks_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_ks_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_ks_methods.mod' due to: lri_ks_methods.o /build/reproducible-path/cp2k-8.1/src/lri_ks_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 lri_environment_types.mod atomic_kind_types.mod qs_o3c_types.mod qs_neighbor_list_types.mod ri_environment_methods.mod base_hooks.mod qs_o3c_methods.mod lri_compression.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_forces.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_forces.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_o3c_types.mod basis_set_types.mod qs_neighbor_list_types.mod kpoint_types.mod qs_ks_types.mod atomic_kind_types.mod qs_force_types.mod virial_types.mod lri_environment_types.mod kinds.mod base_hooks.mod lri_integrals.mod virial_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_forces.F lri_forces.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:48:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_forces.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_forces.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_forces.mod' due to: lri_forces.o /build/reproducible-path/cp2k-8.1/src/lri_forces.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_o3c_types.mod basis_set_types.mod qs_neighbor_list_types.mod kpoint_types.mod qs_ks_types.mod atomic_kind_types.mod qs_force_types.mod virial_types.mod lri_environment_types.mod kinds.mod base_hooks.mod lri_integrals.mod virial_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod admm_types.mod pw_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod lri_environment_types.mod cp_para_types.mod virial_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod ps_implicit_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod qs_charges_types.mod input_section_types.mod qs_force_types.mod task_list_types.mod qs_ks_types.mod qs_energy_types.mod pw_grid_types.mod input_constants.mod lri_forces.mod qs_ks_qmmm_methods.mod pw_methods.mod cp_fm_struct.mod kinds.mod kahan_sum.mod pw_poisson_methods.mod qs_integrate_potential.mod cp_output_handling.mod lri_environment_methods.mod cp_dbcsr_operations.mod message_passing.mod cp_ddapc.mod qs_collocate_density.mod lri_ks_methods.mod cp_log_handling.mod base_hooks.mod xc.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod pw_pool_types.mod qs_ks_types.mod qs_force_types.mod cell_types.mod qs_cdft_types.mod qs_charges_types.mod qs_mo_types.mod admm_types.mod qs_rho_types.mod ps_implicit_types.mod pw_poisson_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod task_list_types.mod lri_environment_types.mod cp_log_handling.mod kinds.mod qs_integrate_potential.mod cp_output_handling.mod qs_ks_qmmm_methods.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod kahan_sum.mod lri_ks_methods.mod pw_poisson_methods.mod qs_collocate_density.mod cp_ddapc.mod pw_methods.mod xc.mod lri_environment_methods.mod base_hooks.mod input_constants.mod lri_forces.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ks_utils.F qs_ks_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:34:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:49:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_utils.F90 /build/reproducible-path/cp2k-8.1/src/qs_ks_utils.F:1344:77: 1344 | cdft_control%strength(igroup) @@ -42870,381 +43329,69 @@ 797 | full_scaling = -dft_control%sic_scaling_a*nelec | ^ Warning: 'nelec' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_utils.mod' due to: qs_ks_utils.o /build/reproducible-path/cp2k-8.1/src/qs_ks_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod admm_types.mod pw_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod lri_environment_types.mod cp_para_types.mod virial_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod ps_implicit_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod qs_charges_types.mod input_section_types.mod qs_force_types.mod task_list_types.mod qs_ks_types.mod qs_energy_types.mod pw_grid_types.mod input_constants.mod lri_forces.mod qs_ks_qmmm_methods.mod pw_methods.mod cp_fm_struct.mod kinds.mod kahan_sum.mod pw_poisson_methods.mod qs_integrate_potential.mod cp_output_handling.mod lri_environment_methods.mod cp_dbcsr_operations.mod message_passing.mod cp_ddapc.mod qs_collocate_density.mod lri_ks_methods.mod cp_log_handling.mod base_hooks.mod xc.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'efield_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/efield_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_control_types.mod cp_para_types.mod qs_rho_types.mod pw_types.mod qs_kind_types.mod qs_force_types.mod qs_environment_types.mod cell_types.mod particle_types.mod qs_energy_types.mod input_constants.mod mathconstants.mod message_passing.mod base_hooks.mod kinds.mod kahan_sum.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/efield_utils.F efield_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:34:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"efield_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' efield_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'efield_utils.mod' due to: efield_utils.o /build/reproducible-path/cp2k-8.1/src/efield_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_control_types.mod cp_para_types.mod qs_rho_types.mod pw_types.mod qs_kind_types.mod qs_force_types.mod qs_environment_types.mod cell_types.mod particle_types.mod qs_energy_types.mod input_constants.mod mathconstants.mod message_passing.mod base_hooks.mod kinds.mod kahan_sum.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_rho_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_rho_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod lri_environment_types.mod qs_oce_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_local_rho_types.mod pw_pool_types.mod atomic_kind_types.mod qs_ks_types.mod task_list_types.mod qs_rho_atom_methods.mod ri_environment_methods.mod pw_methods.mod kinds.mod cp_dbcsr_operations.mod lri_environment_methods.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_rho_methods.F qs_rho_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:34:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_rho_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_rho_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_rho_methods.mod' due to: qs_rho_methods.o /build/reproducible-path/cp2k-8.1/src/qs_rho_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod lri_environment_types.mod qs_oce_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_local_rho_types.mod pw_pool_types.mod atomic_kind_types.mod qs_ks_types.mod task_list_types.mod qs_rho_atom_methods.mod ri_environment_methods.mod pw_methods.mod kinds.mod cp_dbcsr_operations.mod lri_environment_methods.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod cp_log_handling.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kg_correction.o' due to: /build/reproducible-path/cp2k-8.1/src/kg_correction.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod qs_rho_types.mod pw_types.mod xc_rho_set_types.mod lri_environment_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod xc_rho_cflags_types.mod kg_environment_types.mod pw_pool_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod input_constants.mod lri_forces.mod pw_methods.mod qs_vxc.mod qs_rho_methods.mod kinds.mod qs_integrate_potential.mod lri_environment_methods.mod message_passing.mod xc_derivatives.mod lri_ks_methods.mod base_hooks.mod xc.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kg_correction.F kg_correction.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:35:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_correction.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_correction.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kg_correction.mod' due to: kg_correction.o /build/reproducible-path/cp2k-8.1/src/kg_correction.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod qs_rho_types.mod pw_types.mod xc_rho_set_types.mod lri_environment_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod xc_rho_cflags_types.mod kg_environment_types.mod pw_pool_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod input_constants.mod lri_forces.mod pw_methods.mod qs_vxc.mod qs_rho_methods.mod kinds.mod qs_integrate_potential.mod lri_environment_methods.mod message_passing.mod xc_derivatives.mod lri_ks_methods.mod base_hooks.mod xc.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hartree_local_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hartree_local_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hartree_local_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_rho0_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_local_rho_types.mod pw_poisson_types.mod atprop_types.mod atomic_kind_types.mod qs_charges_types.mod mathconstants.mod util.mod kinds.mod qs_harmonics_atom.mod message_passing.mod qs_grid_atom.mod base_hooks.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hartree_local_methods.F hartree_local_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:35:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hartree_local_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hartree_local_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hartree_local_methods.mod' due to: hartree_local_methods.o /build/reproducible-path/cp2k-8.1/src/hartree_local_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 hartree_local_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_rho0_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_local_rho_types.mod pw_poisson_types.mod atprop_types.mod atomic_kind_types.mod qs_charges_types.mod mathconstants.mod util.mod kinds.mod qs_harmonics_atom.mod message_passing.mod qs_grid_atom.mod base_hooks.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_gks.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_gks.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dg_types.mod multipole_types.mod pw_pool_types.mod semi_empirical_mpole_types.mod pw_grid_types.mod semi_empirical_types.mod dg_rho0_types.mod base_hooks.mod mathconstants.mod semi_empirical_int_arrays.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_gks.F semi_empirical_int_gks.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:35:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_gks.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_gks.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_gks.mod' due to: semi_empirical_int_gks.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_gks.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dg_types.mod multipole_types.mod pw_pool_types.mod semi_empirical_mpole_types.mod pw_grid_types.mod semi_empirical_types.mod dg_rho0_types.mod base_hooks.mod mathconstants.mod semi_empirical_int_arrays.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_debug.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod input_constants.mod base_hooks.mod semi_empirical_int_arrays.mod semi_empirical_int3_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F semi_empirical_int_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:35:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_utils.F90 -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1214:38: - - 1214 | add = (pij + pkl)**2 - | ^ -Warning: 'pkl' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1214:38: Warning: 'pij' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:314:38: - - 314 | add = (pij + pkl)**2 - | ^ -Warning: 'pkl' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:314:38: Warning: 'pij' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:841:24: - - 841 | fact = fact*0.5_dp - | ^ -Warning: 'fact' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:875:37: - - 875 | IF (l1 == 0 .AND. l2 == 2 .AND. (m2 == CLMyy .OR. m2 == CLMxx)) THEN - | ^ -Warning: 'm2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:940:37: - - 940 | IF (l1 == 2 .AND. l2 == 2 .AND. (((m1 == CLMyy) .AND. (m2 == CLMyy)) .OR. ((m1 == CLMxx) .AND. (m2 == CLMxx)))) THEN - | ^ -Warning: 'm1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:843:23: - - 843 | IF (l1 == 0 .AND. l2 == 0) THEN - | ^ -Warning: 'l2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:849:37: - - 849 | IF (l1 == 0 .AND. l2 == 1 .AND. m2 == CLMz) THEN - | ^ -Warning: 'l1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:920:23: - - 920 | db = db/2.0_dp - | ^ -Warning: 'db' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:923:109: - - 923 | + add0/SQRT((r - db)**2 + (da + db)**2 + add)**3 - add0/SQRT((r + db)**2 + (da + db)**2 + add)**3 - | ^ -Warning: 'da' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:670:37: - - 670 | IF (l1 == 0 .AND. l2 == 2 .AND. (m2 == CLMyy .OR. m2 == CLMxx)) THEN - | ^ -Warning: 'm2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:735:37: - - 735 | IF (l1 == 2 .AND. l2 == 2 .AND. (((m1 == CLMyy) .AND. (m2 == CLMyy)) .OR. ((m1 == CLMxx) .AND. (m2 == CLMxx)))) THEN - | ^ -Warning: 'm1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:638:23: - - 638 | IF (l1 == 0 .AND. l2 == 0) THEN - | ^ -Warning: 'l2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:644:37: - - 644 | IF (l1 == 0 .AND. l2 == 1 .AND. m2 == CLMz) THEN - | ^ -Warning: 'l1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:640:28: - - 640 | charg = -charg*fact - | ^ -Warning: 'fact' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:715:23: - - 715 | db = db/2.0_dp - | ^ -Warning: 'db' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:718:117: - - 718 | + (r - db)/SQRT((r - db)**2 + (da + db)**2 + add)**3 - (r + db)/SQRT((r + db)**2 + (da + db)**2 + add)**3 - | ^ -Warning: 'da' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:467:37: - - 467 | IF (l1 == 0 .AND. l2 == 2 .AND. (m2 == CLMyy .OR. m2 == CLMxx)) THEN - | ^ -Warning: 'm2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:533:37: - - 533 | IF (l1 == 2 .AND. l2 == 2 .AND. (((m1 == CLMyy) .AND. (m2 == CLMyy)) .OR. ((m1 == CLMxx) .AND. (m2 == CLMxx)))) THEN - | ^ -Warning: 'm1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:436:23: - - 436 | IF (l1 == 0 .AND. l2 == 0) THEN - | ^ -Warning: 'l2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:441:37: - - 441 | IF (l1 == 0 .AND. l2 == 1 .AND. m2 == CLMz) THEN - | ^ -Warning: 'l1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:443:34: - - 443 | charg = charg*0.5_dp*fact - | ^ -Warning: 'fact' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:513:23: - - 513 | db = db/2.0_dp - | ^ -Warning: 'db' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:516:107: - - 516 | + 1.0_dp/SQRT((r - db)**2 + (da + db)**2 + add) - 1.0_dp/SQRT((r + db)**2 + (da + db)**2 + add) - | ^ -Warning: 'da' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1958:60: - - 1958 | d_d(:, 1, 5) = pt5sq3*(s2a_d*sb2 + s2a*sb2_d) - | ^ -Warning: 'sb2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1959:60: - - 1959 | d_d(:, 2, 5) = 0.5_dp*(s2a_d*s2b + s2a*s2b_d) - | ^ -Warning: 's2b' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1961:83: - - 1961 | d_d(:, 4, 5) = s2a_d*(cb2 + 0.5_dp*sb2) + s2a*(cb2_d + 0.5_dp*sb2_d) - | ^ -Warning: 's2a' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1941:83: - - 1941 | d_d(:, 4, 1) = c2a_d*(cb2 + 0.5_dp*sb2) + c2a*(cb2_d + 0.5_dp*sb2_d) - | ^ -Warning: 'cb2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1954:49: - - 1954 | d_d(:, 2, 4) = sa_d*c2b + sa*c2b_d - | ^ -Warning: 'c2b' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1941:83: - - 1941 | d_d(:, 4, 1) = c2a_d*(cb2 + 0.5_dp*sb2) + c2a*(cb2_d + 0.5_dp*sb2_d) - | ^ -Warning: 'c2a' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1911:37: - - 1911 | r_d = (/x11, x22, x33/)/r - | ^ -Warning: 'x33' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1700:80: - - 1700 | sqb, sqb2i, x11, x22, x33 - | ^ -Warning: 'x22' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1700:75: - - 1700 | sqb, sqb2i, x11, x22, x33 - | ^ -Warning: 'x11' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F:1919:42: - - 1919 | sb_d = (sqb_d*r - sqb*r_d)*r2i - | ^ -Warning: 'sqb' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_utils.mod' due to: semi_empirical_int_utils.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_utils.F /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_debug.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod input_constants.mod base_hooks.mod semi_empirical_int_arrays.mod semi_empirical_int3_utils.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_num.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_num.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_args.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 multipole_types.mod semi_empirical_types.mod taper_types.mod input_constants.mod base_hooks.mod semi_empirical_int_arrays.mod semi_empirical_int_utils.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_num.F semi_empirical_int_num.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:35:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_num.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_num.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_num.mod' due to: semi_empirical_int_num.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_num.F /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_args.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 multipole_types.mod semi_empirical_types.mod taper_types.mod input_constants.mod base_hooks.mod semi_empirical_int_arrays.mod semi_empirical_int_utils.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_ana.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_debug.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_args.f90 multipole_types.mod taper_types.mod semi_empirical_types.mod input_constants.mod base_hooks.mod semi_empirical_int_arrays.mod semi_empirical_int_utils.mod physcon.mod semi_empirical_int_num.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F semi_empirical_int_ana.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:35:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_ana.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_ana.F90 -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F:522:93: - - 522 | dscale = dscale + dzz*fnj1(ig)*EXP(-ax) - dax*zz*fnj1(ig)*EXP(-ax) - | ^ -Warning: 'dzz' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F:422:73: - - 422 | dscale = SIGN(1.0_dp, scale*tmp)*(dscale*tmp + scale*dtmp) - | ^ -Warning: 'dtmp' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F:216:57: - - 216 | tmp_d(3, m) = dcore(1, n)*drij(3) - | ^ -Warning: 'drij[2]' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F:215:57: - - 215 | tmp_d(2, m) = dcore(1, n)*drij(2) - | ^ -Warning: 'drij[1]' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F:214:57: - - 214 | tmp_d(1, m) = dcore(1, n)*drij(1) - | ^ -Warning: 'drij[0]' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_int_ana.mod' due to: semi_empirical_int_ana.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_ana.F /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_debug.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_args.f90 multipole_types.mod taper_types.mod semi_empirical_types.mod input_constants.mod base_hooks.mod semi_empirical_int_arrays.mod semi_empirical_int_utils.mod physcon.mod semi_empirical_int_num.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_store_int_types.mod semi_empirical_types.mod input_constants.mod base_hooks.mod semi_empirical_int_gks.mod semi_empirical_int_ana.mod hfx_compression_methods.mod semi_empirical_int_num.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_integrals.F semi_empirical_integrals.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:35:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_integrals.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_integrals.mod' due to: semi_empirical_integrals.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_store_int_types.mod semi_empirical_types.mod input_constants.mod base_hooks.mod semi_empirical_int_gks.mod semi_empirical_int_ana.mod hfx_compression_methods.mod semi_empirical_int_num.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_utils.mod' due to: qs_ks_utils.o /build/reproducible-path/cp2k-8.1/src/qs_ks_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod pw_pool_types.mod qs_ks_types.mod qs_force_types.mod cell_types.mod qs_cdft_types.mod qs_charges_types.mod qs_mo_types.mod admm_types.mod qs_rho_types.mod ps_implicit_types.mod pw_poisson_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod task_list_types.mod lri_environment_types.mod cp_log_handling.mod kinds.mod qs_integrate_potential.mod cp_output_handling.mod qs_ks_qmmm_methods.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod kahan_sum.mod lri_ks_methods.mod pw_poisson_methods.mod qs_collocate_density.mod cp_ddapc.mod pw_methods.mod xc.mod lri_environment_methods.mod base_hooks.mod input_constants.mod lri_forces.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_fock_matrix_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/ewalds_multipole_sr.fypp semi_empirical_store_int_types.mod semi_empirical_types.mod semi_empirical_integrals.mod base_hooks.mod semi_empirical_int_arrays.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_integrals.F se_fock_matrix_integrals.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:35:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix_integrals.F90 -/build/reproducible-path/cp2k-8.1/src/se_fock_matrix_integrals.F:1105:68: - - 1105 | $: ewalds_multipole_sr_macro(mode="PURE_COULOMB") - | ^ -Warning: 'ch_j' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/se_fock_matrix_integrals.F:1105:68: Warning: 'ch_i' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_fock_matrix_integrals.mod' due to: se_fock_matrix_integrals.o /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/ewalds_multipole_sr.fypp semi_empirical_store_int_types.mod semi_empirical_types.mod semi_empirical_integrals.mod base_hooks.mod semi_empirical_int_arrays.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rtp_admm_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/rtp_admm_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod pw_types.mod input_section_types.mod cp_control_types.mod task_list_types.mod kinds.mod hfx_admm_utils.mod cp_gemm_interface.mod cp_dbcsr_operations.mod cp_fm_cholesky.mod qs_collocate_density.mod cp_fm_basic_linalg.mod base_hooks.mod mathconstants.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rtp_admm_methods.F rtp_admm_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:49:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rtp_admm_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rtp_admm_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rtp_admm_methods.mod' due to: rtp_admm_methods.o /build/reproducible-path/cp2k-8.1/src/rtp_admm_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod pw_types.mod input_section_types.mod cp_control_types.mod task_list_types.mod kinds.mod hfx_admm_utils.mod cp_gemm_interface.mod cp_dbcsr_operations.mod cp_fm_cholesky.mod qs_collocate_density.mod cp_fm_basic_linalg.mod base_hooks.mod mathconstants.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_neighbor_list_control.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_neighbor_list_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod atomic_kind_types.mod cp_para_types.mod input_section_types.mod fist_neighbor_list_types.mod particle_types.mod exclusion_types.mod pair_potential_types.mod cell_types.mod distribution_1d_types.mod fist_neighbor_lists.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_neighbor_list_control.F fist_neighbor_list_control.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:36:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_neighbor_list_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_neighbor_list_control.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_neighbor_list_control.mod' due to: fist_neighbor_list_control.o /build/reproducible-path/cp2k-8.1/src/fist_neighbor_list_control.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod atomic_kind_types.mod cp_para_types.mod input_section_types.mod fist_neighbor_list_types.mod particle_types.mod exclusion_types.mod pair_potential_types.mod cell_types.mod distribution_1d_types.mod fist_neighbor_lists.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_angmom.mod' due to: ai_angmom.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewalds_multipole.o' due to: /build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/ewalds_multipole_sr.fypp dg_types.mod parallel_rng_types.mod cell_types.mod particle_types.mod dg_rho0_types.mod fist_nonbond_env_types.mod fist_neighbor_list_types.mod pw_pool_types.mod structure_factor_types.mod distribution_1d_types.mod damping_dipole_types.mod atomic_kind_types.mod ewald_pw_types.mod input_section_types.mod ewald_environment_types.mod pw_grid_types.mod mathconstants.mod kinds.mod message_passing.mod bibliography.mod mathlib.mod cp_log_handling.mod base_hooks.mod structure_factors.mod fist_neighbor_list_control.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F ewalds_multipole.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:36:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewalds_multipole.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewalds_multipole.F90 -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:600:46: - - 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) - | ^ -Warning: 'tij' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:555:107: - - 555 | ptens12, ptens13, ptens21, ptens22, ptens23, ptens31, ptens32, ptens33, r, rab2, tij, & - | ^ -note: 'tij' was declared here -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:554:40: - - 554 | REAL(KIND=dp) :: alpha, ch_i, ch_j, ef0_i, ef0_j, eloc, fac, fac_ij, ir, irab2, ptens11, & - | ^ -Warning: 'ch_j' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:554:34: - - 554 | REAL(KIND=dp) :: alpha, ch_i, ch_j, ef0_i, ef0_j, eloc, fac, fac_ij, ir, irab2, ptens11, & - | ^ -Warning: 'ch_i' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:481:46: - - 481 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_GAUSS", damping=False, store_energy=True, store_forces=True) - | ^ -Warning: 'tij' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:382:32: - - 382 | rcut, tij, tmp, tmp1, tmp11, tmp12, tmp13, tmp2, tmp21, tmp22, tmp23, tmp31, tmp32, & - | ^ -note: 'tij' was declared here -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:378:46: - - 378 | REAL(KIND=dp) :: alpha, beta, ch_i, ch_j, dampa_ij, dampa_ji, dampaexpi, dampaexpj, & - | ^ -Warning: 'ch_j' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:378:40: - - 378 | REAL(KIND=dp) :: alpha, beta, ch_i, ch_j, dampa_ij, dampa_ji, dampaexpi, dampaexpj, & - | ^ -Warning: 'ch_i' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:600:75: - - 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) - | ^ -Warning: 'efield2_sr.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:161:70: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_operators_ao.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod particle_types.mod cell_types.mod block_p_types.mod ai_moments.mod cp_log_handling.mod mathconstants.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_os_rr.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F qs_operators_ao.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:49:24 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_operators_ao.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_operators_ao.F90 +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1477:13: - 161 | efield2_sr - | ^ -note: 'efield2_sr.dim[1].stride' was declared here -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:600:75: + 1477 | IF (jatom /= last_jatom) THEN + | ^ +Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1472:63: - 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) - | ^ -Warning: 'efield2_sr.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:161:70: + 1472 | IF (ABS(rab(1)) > Lxo2 .OR. ABS(rab(2)) > Lyo2 .OR. ABS(rab(3)) > Lzo2) CYCLE + | ^ +Warning: 'lzo2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1472:63: Warning: 'lyo2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1472:63: Warning: 'lxo2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1195:13: - 161 | efield2_sr - | ^ -note: 'efield2_sr.offset' was declared here -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:600:72: + 1195 | IF (jatom /= last_jatom) THEN + | ^ +Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1190:63: - 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) - | ^ -Warning: 'efield1_sr.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:160:82: + 1190 | IF (ABS(rab(1)) > Lxo2 .OR. ABS(rab(2)) > Lyo2 .OR. ABS(rab(3)) > Lzo2) CYCLE + | ^ +Warning: 'lzo2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1190:63: Warning: 'lyo2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1190:63: Warning: 'lxo2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:919:13: - 160 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: efield1_lr, efield1_sr, efield2_lr, & - | ^ -note: 'efield1_sr.dim[1].stride' was declared here -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:600:72: + 919 | IF (jatom /= last_jatom) THEN + | ^ +Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:916:63: - 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) - | ^ -Warning: 'efield1_sr.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:160:82: + 916 | IF (ABS(rab(1)) > Lxo2 .OR. ABS(rab(2)) > Lyo2 .OR. ABS(rab(3)) > Lzo2) CYCLE + | ^ +Warning: 'lzo2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:916:63: Warning: 'lyo2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:916:63: Warning: 'lxo2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:534:13: - 160 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: efield1_lr, efield1_sr, efield2_lr, & - | ^ -note: 'efield1_sr.offset' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewalds_multipole.mod' due to: ewalds_multipole.o /build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/ewalds_multipole_sr.fypp dg_types.mod parallel_rng_types.mod cell_types.mod particle_types.mod dg_rho0_types.mod fist_nonbond_env_types.mod fist_neighbor_list_types.mod pw_pool_types.mod structure_factor_types.mod distribution_1d_types.mod damping_dipole_types.mod atomic_kind_types.mod ewald_pw_types.mod input_section_types.mod ewald_environment_types.mod pw_grid_types.mod mathconstants.mod kinds.mod message_passing.mod bibliography.mod mathlib.mod cp_log_handling.mod base_hooks.mod structure_factors.mod fist_neighbor_list_control.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_fock_matrix_coulomb.o' due to: /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_coulomb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod fist_nonbond_env_types.mod pw_poisson_types.mod semi_empirical_mpole_types.mod atprop_types.mod semi_empirical_types.mod distribution_1d_types.mod semi_empirical_store_int_types.mod multipole_types.mod atomic_kind_types.mod ewald_pw_types.mod input_section_types.mod qs_force_types.mod ewald_environment_types.mod qs_energy_types.mod input_constants.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod kinds.mod se_fock_matrix_integrals.mod cp_output_handling.mod cp_dbcsr_operations.mod ewalds_multipole.mod virial_methods.mod semi_empirical_utils.mod message_passing.mod semi_empirical_mpole_methods.mod cp_log_handling.mod base_hooks.mod fist_neighbor_list_control.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_coulomb.F se_fock_matrix_coulomb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:36:32 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix_coulomb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix_coulomb.F90 -/build/reproducible-path/cp2k-8.1/src/se_fock_matrix_coulomb.F:688:46: + 534 | IF (jatom /= last_jatom) THEN + | ^ +Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:180:13: - 688 | ALLOCATE (forces_g(3, forces_g_size)) - | ^ -Warning: 'forces_g_size' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_fock_matrix_coulomb.mod' due to: se_fock_matrix_coulomb.o /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_coulomb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod fist_nonbond_env_types.mod pw_poisson_types.mod semi_empirical_mpole_types.mod atprop_types.mod semi_empirical_types.mod distribution_1d_types.mod semi_empirical_store_int_types.mod multipole_types.mod atomic_kind_types.mod ewald_pw_types.mod input_section_types.mod qs_force_types.mod ewald_environment_types.mod qs_energy_types.mod input_constants.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod kinds.mod se_fock_matrix_integrals.mod cp_output_handling.mod cp_dbcsr_operations.mod ewalds_multipole.mod virial_methods.mod semi_empirical_utils.mod message_passing.mod semi_empirical_mpole_methods.mod cp_log_handling.mod base_hooks.mod fist_neighbor_list_control.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_fock_matrix_dbg.o' due to: /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_dbg.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_store_int_types.mod qs_environment_types.mod qs_energy_types.mod base_hooks.mod se_fock_matrix_coulomb.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_dbg.F se_fock_matrix_dbg.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:36:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix_dbg.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix_dbg.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_fock_matrix_dbg.mod' due to: se_fock_matrix_dbg.o /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_dbg.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_store_int_types.mod qs_environment_types.mod qs_energy_types.mod base_hooks.mod se_fock_matrix_coulomb.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_fock_matrix_exchange.o' due to: /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_exchange.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod cp_control_types.mod qs_environment_types.mod particle_types.mod semi_empirical_types.mod semi_empirical_store_int_types.mod multipole_types.mod atomic_kind_types.mod qs_force_types.mod input_constants.mod semi_empirical_int_arrays.mod kinds.mod se_fock_matrix_integrals.mod virial_methods.mod semi_empirical_utils.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_exchange.F se_fock_matrix_exchange.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:36:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix_exchange.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix_exchange.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_fock_matrix_exchange.mod' due to: se_fock_matrix_exchange.o /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_exchange.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod cp_control_types.mod qs_environment_types.mod particle_types.mod semi_empirical_types.mod semi_empirical_store_int_types.mod multipole_types.mod atomic_kind_types.mod qs_force_types.mod input_constants.mod semi_empirical_int_arrays.mod kinds.mod se_fock_matrix_integrals.mod virial_methods.mod semi_empirical_utils.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_fock_matrix.o' due to: /build/reproducible-path/cp2k-8.1/src/se_fock_matrix.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atprop_types.mod semi_empirical_store_int_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod kinds.mod cp_output_handling.mod se_fock_matrix_dbg.mod cp_log_handling.mod se_fock_matrix_exchange.mod base_hooks.mod se_fock_matrix_coulomb.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_fock_matrix.F se_fock_matrix.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:36:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_fock_matrix.mod' due to: se_fock_matrix.o /build/reproducible-path/cp2k-8.1/src/se_fock_matrix.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atprop_types.mod semi_empirical_store_int_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod kinds.mod cp_output_handling.mod se_fock_matrix_dbg.mod cp_log_handling.mod se_fock_matrix_exchange.mod base_hooks.mod se_fock_matrix_coulomb.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rtp_admm_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/rtp_admm_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_rho_types.mod pw_types.mod qs_mo_types.mod cp_para_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod input_section_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod mathconstants.mod cp_gemm_interface.mod hfx_admm_utils.mod kinds.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_collocate_density.mod cp_fm_cholesky.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rtp_admm_methods.F rtp_admm_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:36:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rtp_admm_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rtp_admm_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rtp_admm_methods.mod' due to: rtp_admm_methods.o /build/reproducible-path/cp2k-8.1/src/rtp_admm_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_rho_types.mod pw_types.mod qs_mo_types.mod cp_para_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod input_section_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod mathconstants.mod cp_gemm_interface.mod hfx_admm_utils.mod kinds.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_collocate_density.mod cp_fm_cholesky.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_angmom.mod' due to: ai_angmom.o + 180 | IF (jatom /= last_jatom) THEN + | ^ +Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_operators_ao.mod' due to: qs_operators_ao.o /build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod particle_types.mod cell_types.mod block_p_types.mod ai_moments.mod cp_log_handling.mod mathconstants.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_os_rr.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'commutator_rpnl.o' due to: /build/reproducible-path/cp2k-8.1/src/commutator_rpnl.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod particle_types.mod external_potential_types.mod qs_neighbor_list_types.mod cell_types.mod sap_kind_types.mod block_p_types.mod ai_moments.mod ai_overlap.mod base_hooks.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'commutator_rpnl.o' due to: /build/reproducible-path/cp2k-8.1/src/commutator_rpnl.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod sap_kind_types.mod external_potential_types.mod qs_kind_types.mod particle_types.mod cell_types.mod block_p_types.mod ai_moments.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_overlap.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/commutator_rpnl.F commutator_rpnl.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:36:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"commutator_rpnl.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' commutator_rpnl.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:49:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"commutator_rpnl.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' commutator_rpnl.F90 /build/reproducible-path/cp2k-8.1/src/commutator_rpnl.F:645:72: 645 | !$ hash = MOD((iatom - 1)*natom + jatom, nlock) + 1 @@ -43389,67 +43536,11 @@ 93 | REAL(KIND=dp) :: dac, ppnl_radius | ^ note: 'ppnl_radius' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'commutator_rpnl.mod' due to: commutator_rpnl.o /build/reproducible-path/cp2k-8.1/src/commutator_rpnl.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod particle_types.mod external_potential_types.mod qs_neighbor_list_types.mod cell_types.mod sap_kind_types.mod block_p_types.mod ai_moments.mod ai_overlap.mod base_hooks.mod orbital_pointers.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'moments_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/moments_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod qs_kind_types.mod particle_types.mod fist_environment_types.mod qs_environment_types.mod cell_types.mod distribution_1d_types.mod input_constants.mod message_passing.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/moments_utils.F moments_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:38:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"moments_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' moments_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'moments_utils.mod' due to: moments_utils.o /build/reproducible-path/cp2k-8.1/src/moments_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod qs_kind_types.mod particle_types.mod fist_environment_types.mod qs_environment_types.mod cell_types.mod distribution_1d_types.mod input_constants.mod message_passing.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_operators_ao.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_kind_types.mod particle_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cell_types.mod block_p_types.mod ai_moments.mod cp_log_handling.mod mathconstants.mod base_hooks.mod orbital_pointers.mod kinds.mod ai_os_rr.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F qs_operators_ao.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:38:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_operators_ao.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_operators_ao.F90 -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1477:13: - - 1477 | IF (jatom /= last_jatom) THEN - | ^ -Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1472:63: - - 1472 | IF (ABS(rab(1)) > Lxo2 .OR. ABS(rab(2)) > Lyo2 .OR. ABS(rab(3)) > Lzo2) CYCLE - | ^ -Warning: 'lzo2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1472:63: Warning: 'lyo2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1472:63: Warning: 'lxo2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1195:13: - - 1195 | IF (jatom /= last_jatom) THEN - | ^ -Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1190:63: - - 1190 | IF (ABS(rab(1)) > Lxo2 .OR. ABS(rab(2)) > Lyo2 .OR. ABS(rab(3)) > Lzo2) CYCLE - | ^ -Warning: 'lzo2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1190:63: Warning: 'lyo2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:1190:63: Warning: 'lxo2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:919:13: - - 919 | IF (jatom /= last_jatom) THEN - | ^ -Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:916:63: - - 916 | IF (ABS(rab(1)) > Lxo2 .OR. ABS(rab(2)) > Lyo2 .OR. ABS(rab(3)) > Lzo2) CYCLE - | ^ -Warning: 'lzo2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:916:63: Warning: 'lyo2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:916:63: Warning: 'lxo2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:534:13: - - 534 | IF (jatom /= last_jatom) THEN - | ^ -Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F:180:13: - - 180 | IF (jatom /= last_jatom) THEN - | ^ -Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_operators_ao.mod' due to: qs_operators_ao.o /build/reproducible-path/cp2k-8.1/src/qs_operators_ao.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod qs_kind_types.mod particle_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cell_types.mod block_p_types.mod ai_moments.mod cp_log_handling.mod mathconstants.mod base_hooks.mod orbital_pointers.mod kinds.mod ai_os_rr.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'commutator_rpnl.mod' due to: commutator_rpnl.o /build/reproducible-path/cp2k-8.1/src/commutator_rpnl.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod sap_kind_types.mod external_potential_types.mod qs_kind_types.mod particle_types.mod cell_types.mod block_p_types.mod ai_moments.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_overlap.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_moments.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_moments.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod block_p_types.mod distribution_1d_types.mod cp_fm_types.mod cp_cfm_types.mod atomic_kind_types.mod cp_result_types.mod qs_ks_types.mod ai_moments.mod mathconstants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod cp_result_methods.mod kinds.mod ai_angmom.mod cp_dbcsr_operations.mod physcon.mod commutator_rpnl.mod moments_utils.mod message_passing.mod cp_dbcsr_cp2k_link.mod particle_methods.mod base_hooks.mod orbital_pointers.mod qs_operators_ao.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_moments.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_moments.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod cp_result_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod rt_propagation_types.mod cp_fm_types.mod block_p_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod distribution_1d_types.mod cp_cfm_types.mod cp_control_types.mod kinds.mod ai_angmom.mod cp_gemm_interface.mod physcon.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod ai_moments.mod message_passing.mod cp_cfm_basic_linalg.mod moments_utils.mod cp_result_methods.mod qs_operators_ao.mod orbital_pointers.mod particle_methods.mod base_hooks.mod mathconstants.mod commutator_rpnl.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_moments.F qs_moments.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:38:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_moments.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_moments.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:50:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_moments.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_moments.F90 /build/reproducible-path/cp2k-8.1/src/qs_moments.F:493:13: 493 | IF (jatom == last_jatom) THEN @@ -43475,11 +43566,11 @@ 2085 | IF (my_com_nl) THEN | ^ Warning: 'my_com_nl' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_moments.mod' due to: qs_moments.o /build/reproducible-path/cp2k-8.1/src/qs_moments.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod block_p_types.mod distribution_1d_types.mod cp_fm_types.mod cp_cfm_types.mod atomic_kind_types.mod cp_result_types.mod qs_ks_types.mod ai_moments.mod mathconstants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod cp_result_methods.mod kinds.mod ai_angmom.mod cp_dbcsr_operations.mod physcon.mod commutator_rpnl.mod moments_utils.mod message_passing.mod cp_dbcsr_cp2k_link.mod particle_methods.mod base_hooks.mod orbital_pointers.mod qs_operators_ao.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_moments.mod' due to: qs_moments.o /build/reproducible-path/cp2k-8.1/src/qs_moments.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod cp_result_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod rt_propagation_types.mod cp_fm_types.mod block_p_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod distribution_1d_types.mod cp_cfm_types.mod cp_control_types.mod kinds.mod ai_angmom.mod cp_gemm_interface.mod physcon.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod ai_moments.mod message_passing.mod cp_cfm_basic_linalg.mod moments_utils.mod cp_result_methods.mod qs_operators_ao.mod orbital_pointers.mod particle_methods.mod base_hooks.mod mathconstants.mod commutator_rpnl.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_efield_berry.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_efield_berry.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_period_efield_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod block_p_types.mod cp_fm_types.mod cp_cfm_types.mod atomic_kind_types.mod qs_force_types.mod qs_energy_types.mod ai_moments.mod mathconstants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod kinds.mod cp_dbcsr_operations.mod virial_methods.mod cp_fm_basic_linalg.mod message_passing.mod base_hooks.mod qs_moments.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_efield_berry.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_efield_berry.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_mo_types.mod cp_fm_types.mod block_p_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_period_efield_types.mod virial_types.mod cp_cfm_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod qs_moments.mod virial_methods.mod cp_dbcsr_operations.mod ai_moments.mod message_passing.mod cp_cfm_basic_linalg.mod cp_fm_basic_linalg.mod orbital_pointers.mod base_hooks.mod mathconstants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_efield_berry.F qs_efield_berry.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:38:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_efield_berry.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_efield_berry.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:50:56 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_efield_berry.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_efield_berry.F90 /build/reproducible-path/cp2k-8.1/src/qs_efield_berry.F:1050:95: 1050 | force_tmp(iatom, :, i) = force_tmp(iatom, :, i) - fab*hmat(i, idir)*forcea(:) @@ -43492,327 +43583,369 @@ | ^ Warning: 'force_tmp.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/qs_efield_berry.F:691:85: Warning: 'force_tmp.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_efield_berry.mod' due to: qs_efield_berry.o /build/reproducible-path/cp2k-8.1/src/qs_efield_berry.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_period_efield_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod block_p_types.mod cp_fm_types.mod cp_cfm_types.mod atomic_kind_types.mod qs_force_types.mod qs_energy_types.mod ai_moments.mod mathconstants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod kinds.mod cp_dbcsr_operations.mod virial_methods.mod cp_fm_basic_linalg.mod message_passing.mod base_hooks.mod qs_moments.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_efield_berry.mod' due to: qs_efield_berry.o /build/reproducible-path/cp2k-8.1/src/qs_efield_berry.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_mo_types.mod cp_fm_types.mod block_p_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_period_efield_types.mod virial_types.mod cp_cfm_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod qs_moments.mod virial_methods.mod cp_dbcsr_operations.mod ai_moments.mod message_passing.mod cp_cfm_basic_linalg.mod cp_fm_basic_linalg.mod orbital_pointers.mod base_hooks.mod mathconstants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 's_square_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/s_square_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod cp_para_types.mod qs_mo_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod message_passing.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/s_square_methods.F s_square_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:38:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"s_square_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' s_square_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 's_square_methods.mod' due to: s_square_methods.o /build/reproducible-path/cp2k-8.1/src/s_square_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod cp_para_types.mod qs_mo_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod message_passing.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'hartree_local_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/hartree_local_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod qs_charges_types.mod pw_poisson_types.mod atprop_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod qs_rho0_types.mod hartree_local_types.mod qs_kind_types.mod cp_control_types.mod qs_rho_atom_types.mod kinds.mod message_passing.mod qs_harmonics_atom.mod qs_grid_atom.mod util.mod orbital_pointers.mod base_hooks.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/hartree_local_methods.F hartree_local_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:51:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"hartree_local_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' hartree_local_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'hartree_local_methods.mod' due to: hartree_local_methods.o /build/reproducible-path/cp2k-8.1/src/hartree_local_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod qs_charges_types.mod pw_poisson_types.mod atprop_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod qs_rho0_types.mod hartree_local_types.mod qs_kind_types.mod cp_control_types.mod qs_rho_atom_types.mod kinds.mod message_passing.mod qs_harmonics_atom.mod qs_grid_atom.mod util.mod orbital_pointers.mod base_hooks.mod mathconstants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_cdft_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod hirshfeld_types.mod qs_cdft_types.mod pw_env_types.mod qs_rho0_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_energy_types.mod input_constants.mod pw_methods.mod cube_utils.mod kinds.mod kahan_sum.mod grid_api.mod cp_output_handling.mod ao_util.mod message_passing.mod qs_cdft_utils.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F qs_cdft_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:38:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_methods.F90 -/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:916:122: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_efield_local.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_efield_local.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_period_efield_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod qs_moments.mod ai_moments.mod message_passing.mod orbital_pointers.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_efield_local.F qs_efield_local.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:51:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_efield_local.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_efield_local.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_efield_local.mod' due to: qs_efield_local.o /build/reproducible-path/cp2k-8.1/src/qs_efield_local.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_period_efield_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod qs_moments.mod ai_moments.mod message_passing.mod orbital_pointers.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_core_energies.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_core_energies.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod atprop_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_energy_types.mod atomic_kind_types.mod particle_types.mod distribution_1d_types.mod qs_force_types.mod virial_types.mod message_passing.mod mathconstants.mod kinds.mod base_hooks.mod virial_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_core_energies.F qs_core_energies.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:51:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_core_energies.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_core_energies.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_core_energies.mod' due to: qs_core_energies.o /build/reproducible-path/cp2k-8.1/src/qs_core_energies.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod atprop_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_energy_types.mod atomic_kind_types.mod particle_types.mod distribution_1d_types.mod qs_force_types.mod virial_types.mod message_passing.mod mathconstants.mod kinds.mod base_hooks.mod virial_methods.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_sccs.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_sccs.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod pw_pool_types.mod qs_rho_types.mod pw_poisson_types.mod qs_scf_types.mod particle_list_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod message_passing.mod kahan_sum.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod pw_methods.mod cp_realspace_grid_init.mod base_hooks.mod mathconstants.mod rs_methods.mod input_constants.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_sccs.F qs_sccs.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:51:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_sccs.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_sccs.F90 +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:355:38: - 916 | gapw_offset(igroup, i) = gapw_offset(igroup, i) + sign*group(igroup)%coeff(iatom)*mp_rho(jatom)%q0(i) - | ^ -Warning: 'sign' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:791:66: + 355 | filename = mpi_filename + | 1 +Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:440:41: - 791 | TYPE(pw_p_type), DIMENSION(:), POINTER :: charge, rho_r - | ^ -Warning: 'charge.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:791:66: Warning: 'charge.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:161:68: + 440 | filename = mpi_filename + | 1 +Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:723:38: - 161 | REAL(kind=dp), ALLOCATABLE, DIMENSION(:, :, :) :: dP_i_dRj - | ^ -Warning: 'dp_i_drj.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:161:68: Warning: 'dp_i_drj.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:315:35: + 723 | filename = mpi_filename + | 1 +Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:787:38: - 315 | dP_i_dRi = 0.0_dp - | ^ -Warning: 'dp_i_dri.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:311:38: + 787 | filename = mpi_filename + | 1 +Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:823:38: - 311 | d_sum_Pm_dR = 0.0_dp - | ^ -Warning: 'd_sum_pm_dr.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:154:73: + 823 | filename = mpi_filename + | 1 +Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:1228:81: - 154 | LOGICAL, ALLOCATABLE, DIMENSION(:, :) :: atom_in_group + 1228 | !$OMP SHARED(ln_rho_max,norm_drho_elec,rho_elec,q,rho_max,rho_min,ub) + | ^ +Warning: 'q' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:1206:73: + + 1206 | ln_rho_min, q, rho, t, x, y | ^ -Warning: 'atom_in_group.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:154:73: Warning: 'atom_in_group.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:471:115: +note: 'q' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:1228:81: - 471 | group(igroup)%coeff(ip)*dP_i_dRi(:, iatom) - | ^ -Warning: 'ip' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:172:66: + 1228 | !$OMP SHARED(ln_rho_max,norm_drho_elec,rho_elec,q,rho_max,rho_min,ub) + | ^ +Warning: 'ln_rho_max' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:1205:92: - 172 | TYPE(pw_p_type), DIMENSION(:), POINTER :: charge - | ^ -Warning: 'charge.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:172:66: Warning: 'charge.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F:724:98: + 1205 | REAL(KIND=dp) :: diff, e, eps_elec, f, ln_rho_max, & + | ^ +note: 'ln_rho_max' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:972:63: - 724 | rho_r(ispin)%pw%cr3d(k, j, i)*dvol - | ^ -Warning: 'sign' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_cdft_methods.mod' due to: qs_cdft_methods.o /build/reproducible-path/cp2k-8.1/src/qs_cdft_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod hirshfeld_types.mod qs_cdft_types.mod pw_env_types.mod qs_rho0_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_energy_types.mod input_constants.mod pw_methods.mod cube_utils.mod kinds.mod kahan_sum.mod grid_api.mod cp_output_handling.mod ao_util.mod message_passing.mod qs_cdft_utils.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod + 972 | !$OMP SHARED(ln_rho_max,rho_elec,q,rho_max,rho_min) + | ^ +Warning: 'q' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:951:61: + + 951 | q, rho, t, x, y + | ^ +note: 'q' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:972:63: + + 972 | !$OMP SHARED(ln_rho_max,rho_elec,q,rho_max,rho_min) + | ^ +Warning: 'ln_rho_max' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:950:87: + + 950 | REAL(KIND=dp) :: diff, dq, dt, f, ln_rho_max, ln_rho_min, & + | ^ +note: 'ln_rho_max' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:972:63: + + 972 | !$OMP SHARED(ln_rho_max,rho_elec,q,rho_max,rho_min) + | ^ +Warning: 'dq' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_sccs.F:950:68: + + 950 | REAL(KIND=dp) :: diff, dq, dt, f, ln_rho_max, ln_rho_min, & + | ^ +note: 'dq' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_sccs.mod' due to: qs_sccs.o /build/reproducible-path/cp2k-8.1/src/qs_sccs.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod pw_pool_types.mod qs_rho_types.mod pw_poisson_types.mod qs_scf_types.mod particle_list_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod message_passing.mod kahan_sum.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod pw_methods.mod cp_realspace_grid_init.mod base_hooks.mod mathconstants.mod rs_methods.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_apply_restraints.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_apply_restraints.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_mo_types.mod cp_para_types.mod qs_cdft_types.mod qs_environment_types.mod cp_control_types.mod pw_pool_types.mod cp_fm_types.mod qs_energy_types.mod input_constants.mod pw_methods.mod mulliken.mod kinds.mod cp_dbcsr_operations.mod s_square_methods.mod base_hooks.mod qs_cdft_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ks_apply_restraints.F qs_ks_apply_restraints.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:39:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_apply_restraints.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_apply_restraints.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_apply_restraints.mod' due to: qs_ks_apply_restraints.o /build/reproducible-path/cp2k-8.1/src/qs_ks_apply_restraints.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_mo_types.mod cp_para_types.mod qs_cdft_types.mod qs_environment_types.mod cp_control_types.mod pw_pool_types.mod cp_fm_types.mod qs_energy_types.mod input_constants.mod pw_methods.mod mulliken.mod kinds.mod cp_dbcsr_operations.mod s_square_methods.mod base_hooks.mod qs_cdft_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'admm_dm_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/admm_dm_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 task_list_types.mod qs_ks_types.mod cp_control_types.mod admm_dm_types.mod pw_types.mod qs_rho_types.mod cp_log_handling.mod kinds.mod iterate_matrix.mod base_hooks.mod input_constants.mod qs_collocate_density.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/admm_dm_methods.F admm_dm_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:51:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"admm_dm_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' admm_dm_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'admm_dm_methods.mod' due to: admm_dm_methods.o /build/reproducible-path/cp2k-8.1/src/admm_dm_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 task_list_types.mod qs_ks_types.mod cp_control_types.mod admm_dm_types.mod pw_types.mod qs_rho_types.mod cp_log_handling.mod kinds.mod iterate_matrix.mod base_hooks.mod input_constants.mod qs_collocate_density.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_efield_local.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_efield_local.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod qs_period_efield_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod qs_force_types.mod qs_energy_types.mod ai_moments.mod kinds.mod message_passing.mod base_hooks.mod qs_moments.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_efield_local.F qs_efield_local.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:39:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_efield_local.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_efield_local.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_efield_local.mod' due to: qs_efield_local.o /build/reproducible-path/cp2k-8.1/src/qs_efield_local.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod qs_period_efield_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod qs_force_types.mod qs_energy_types.mod ai_moments.mod kinds.mod message_passing.mod base_hooks.mod qs_moments.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kg_correction.o' due to: /build/reproducible-path/cp2k-8.1/src/kg_correction.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod qs_rho_types.mod xc_rho_cflags_types.mod xc_derivative_set_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod xc_rho_set_types.mod input_section_types.mod virial_types.mod cp_control_types.mod kg_environment_types.mod lri_environment_types.mod kinds.mod qs_integrate_potential.mod qs_rho_methods.mod message_passing.mod lri_ks_methods.mod qs_vxc.mod pw_methods.mod xc.mod lri_environment_methods.mod xc_derivatives.mod base_hooks.mod input_constants.mod lri_forces.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kg_correction.F kg_correction.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:51:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_correction.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_correction.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kg_correction.mod' due to: kg_correction.o /build/reproducible-path/cp2k-8.1/src/kg_correction.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod qs_rho_types.mod xc_rho_cflags_types.mod xc_derivative_set_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod xc_rho_set_types.mod input_section_types.mod virial_types.mod cp_control_types.mod kg_environment_types.mod lri_environment_types.mod kinds.mod qs_integrate_potential.mod qs_rho_methods.mod message_passing.mod lri_ks_methods.mod qs_vxc.mod pw_methods.mod xc.mod lri_environment_methods.mod xc_derivatives.mod base_hooks.mod input_constants.mod lri_forces.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'surface_dipole.o' due to: /build/reproducible-path/cp2k-8.1/src/surface_dipole.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod qs_rho_types.mod pw_types.mod qs_subsys_types.mod pw_pool_types.mod pw_env_types.mod qs_environment_types.mod pw_grid_types.mod cell_types.mod qs_energy_types.mod pw_methods.mod base_hooks.mod mathconstants.mod message_passing.mod physcon.mod kinds.mod kahan_sum.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'surface_dipole.o' due to: /build/reproducible-path/cp2k-8.1/src/surface_dipole.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pw_env_types.mod pw_grid_types.mod pw_pool_types.mod cp_control_types.mod pw_types.mod qs_energy_types.mod cell_types.mod qs_rho_types.mod qs_subsys_types.mod message_passing.mod mathconstants.mod kahan_sum.mod kinds.mod pw_methods.mod physcon.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/surface_dipole.F surface_dipole.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:39:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"surface_dipole.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' surface_dipole.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'surface_dipole.mod' due to: surface_dipole.o /build/reproducible-path/cp2k-8.1/src/surface_dipole.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod qs_rho_types.mod pw_types.mod qs_subsys_types.mod pw_pool_types.mod pw_env_types.mod qs_environment_types.mod pw_grid_types.mod cell_types.mod qs_energy_types.mod pw_methods.mod base_hooks.mod mathconstants.mod message_passing.mod physcon.mod kinds.mod kahan_sum.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:51:40 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"surface_dipole.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' surface_dipole.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'surface_dipole.mod' due to: surface_dipole.o /build/reproducible-path/cp2k-8.1/src/surface_dipole.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pw_env_types.mod pw_grid_types.mod pw_pool_types.mod cp_control_types.mod pw_types.mod qs_energy_types.mod cell_types.mod qs_rho_types.mod qs_subsys_types.mod message_passing.mod mathconstants.mod kahan_sum.mod kinds.mod pw_methods.mod physcon.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dft_plus_u.o' due to: /build/reproducible-path/cp2k-8.1/src/dft_plus_u.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_energy_types.mod input_constants.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod physcon.mod message_passing.mod bibliography.mod orbital_symbols.mod particle_methods.mod mathlib.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dft_plus_u.F dft_plus_u.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:39:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dft_plus_u.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dft_plus_u.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dft_plus_u.mod' due to: dft_plus_u.o /build/reproducible-path/cp2k-8.1/src/dft_plus_u.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_energy_types.mod input_constants.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod physcon.mod message_passing.mod bibliography.mod orbital_symbols.mod particle_methods.mod mathlib.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'efield_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/efield_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_control_types.mod pw_types.mod qs_kind_types.mod qs_energy_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod atomic_kind_types.mod message_passing.mod kahan_sum.mod mathconstants.mod kinds.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/efield_utils.F efield_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:51:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"efield_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' efield_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'efield_utils.mod' due to: efield_utils.o /build/reproducible-path/cp2k-8.1/src/efield_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_control_types.mod pw_types.mod qs_kind_types.mod qs_energy_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_rho_types.mod atomic_kind_types.mod message_passing.mod kahan_sum.mod mathconstants.mod kinds.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod hartree_local_types.mod cell_types.mod qs_mo_types.mod lri_environment_types.mod cp_para_types.mod virial_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_local_rho_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod qs_charges_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod admm_methods.mod input_constants.mod qs_sccs.mod qs_ks_qmmm_methods.mod pw_methods.mod xtb_matrices.mod admm_dm_methods.mod cp_gemm_interface.mod qs_dftb_matrices.mod qs_core_energies.mod qs_gapw_densities.mod cp_fm_struct.mod qs_vxc.mod cp_blacs_env.mod hfx_admm_utils.mod qs_vxc_atom.mod kinds.mod qs_ks_utils.mod pw_poisson_methods.mod qs_integrate_potential.mod efield_utils.mod kg_correction.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod hartree_local_methods.mod lri_environment_methods.mod se_fock_matrix.mod rtp_admm_methods.mod message_passing.mod cp_ddapc.mod qs_efield_berry.mod cp_dbcsr_cp2k_link.mod qs_ks_apply_restraints.mod qs_rho0_ggrid.mod mathlib.mod cp_log_handling.mod qs_ks_atom.mod base_hooks.mod qs_efield_local.mod surface_dipole.mod dft_plus_u.mod qmmm_image_charge.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ks_methods.F qs_ks_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:39:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_methods.mod' due to: qs_ks_methods.o /build/reproducible-path/cp2k-8.1/src/qs_ks_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod hartree_local_types.mod cell_types.mod qs_mo_types.mod lri_environment_types.mod cp_para_types.mod virial_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_local_rho_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod qs_charges_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod admm_methods.mod input_constants.mod qs_sccs.mod qs_ks_qmmm_methods.mod pw_methods.mod xtb_matrices.mod admm_dm_methods.mod cp_gemm_interface.mod qs_dftb_matrices.mod qs_core_energies.mod qs_gapw_densities.mod cp_fm_struct.mod qs_vxc.mod cp_blacs_env.mod hfx_admm_utils.mod qs_vxc_atom.mod kinds.mod qs_ks_utils.mod pw_poisson_methods.mod qs_integrate_potential.mod efield_utils.mod kg_correction.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod hartree_local_methods.mod lri_environment_methods.mod se_fock_matrix.mod rtp_admm_methods.mod message_passing.mod cp_ddapc.mod qs_efield_berry.mod cp_dbcsr_cp2k_link.mod qs_ks_apply_restraints.mod qs_rho0_ggrid.mod mathlib.mod cp_log_handling.mod qs_ks_atom.mod base_hooks.mod qs_efield_local.mod surface_dipole.mod dft_plus_u.mod qmmm_image_charge.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_fock_matrix_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/ewalds_multipole_sr.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod semi_empirical_store_int_types.mod kinds.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_integrals.F se_fock_matrix_integrals.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:51:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix_integrals.F90 +/build/reproducible-path/cp2k-8.1/src/se_fock_matrix_integrals.F:1105:68: + + 1105 | $: ewalds_multipole_sr_macro(mode="PURE_COULOMB") + | ^ +Warning: 'ch_j' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/se_fock_matrix_integrals.F:1105:68: Warning: 'ch_i' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_fock_matrix_integrals.mod' due to: se_fock_matrix_integrals.o /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_integrals.F /build/reproducible-path/cp2k-8.1/src/ewalds_multipole_sr.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod semi_empirical_store_int_types.mod kinds.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kg_tnadd_mat.o' due to: /build/reproducible-path/cp2k-8.1/src/kg_tnadd_mat.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod kg_environment_types.mod qs_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod external_potential_types.mod qs_neighbor_list_types.mod ai_overlap_ppl.mod base_hooks.mod cp_dbcsr_cp2k_link.mod virial_methods.mod cp_dbcsr_operations.mod orbital_pointers.mod kinds.mod particle_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kg_tnadd_mat.F kg_tnadd_mat.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:39:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_tnadd_mat.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_tnadd_mat.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kg_tnadd_mat.mod' due to: kg_tnadd_mat.o /build/reproducible-path/cp2k-8.1/src/kg_tnadd_mat.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod kg_environment_types.mod qs_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod external_potential_types.mod qs_neighbor_list_types.mod ai_overlap_ppl.mod base_hooks.mod cp_dbcsr_cp2k_link.mod virial_methods.mod cp_dbcsr_operations.mod orbital_pointers.mod kinds.mod particle_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_fock_matrix_exchange.o' due to: /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_exchange.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod particle_types.mod cell_types.mod qs_force_types.mod semi_empirical_store_int_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod multipole_types.mod kinds.mod se_fock_matrix_integrals.mod virial_methods.mod semi_empirical_utils.mod semi_empirical_int_arrays.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_exchange.F se_fock_matrix_exchange.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:51:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix_exchange.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix_exchange.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_fock_matrix_exchange.mod' due to: se_fock_matrix_exchange.o /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_exchange.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod particle_types.mod cell_types.mod qs_force_types.mod semi_empirical_store_int_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod multipole_types.mod kinds.mod se_fock_matrix_integrals.mod virial_methods.mod semi_empirical_utils.mod semi_empirical_int_arrays.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'core_ppnl.o' due to: /build/reproducible-path/cp2k-8.1/src/core_ppnl.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod external_potential_types.mod qs_neighbor_list_types.mod sap_kind_types.mod ai_overlap.mod base_hooks.mod virial_methods.mod orbital_pointers.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/core_ppnl.F core_ppnl.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:39:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"core_ppnl.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' core_ppnl.F90 -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:106:89: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_neighbor_list_control.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_neighbor_list_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pair_potential_types.mod exclusion_types.mod fist_nonbond_env_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod input_section_types.mod fist_neighbor_list_types.mod atomic_kind_types.mod fist_neighbor_lists.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_neighbor_list_control.F fist_neighbor_list_control.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:51:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_neighbor_list_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_neighbor_list_control.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_neighbor_list_control.mod' due to: fist_neighbor_list_control.o /build/reproducible-path/cp2k-8.1/src/fist_neighbor_list_control.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pair_potential_types.mod exclusion_types.mod fist_nonbond_env_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod input_section_types.mod fist_neighbor_list_types.mod atomic_kind_types.mod fist_neighbor_lists.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewalds_multipole.o' due to: /build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/ewalds_multipole_sr.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod cell_types.mod parallel_rng_types.mod dg_rho0_types.mod fist_nonbond_env_types.mod damping_dipole_types.mod atomic_kind_types.mod pw_grid_types.mod ewald_environment_types.mod distribution_1d_types.mod dg_types.mod input_section_types.mod ewald_pw_types.mod structure_factor_types.mod fist_neighbor_list_types.mod cp_log_handling.mod kinds.mod bibliography.mod message_passing.mod structure_factors.mod fist_neighbor_list_control.mod mathlib.mod base_hooks.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F ewalds_multipole.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:51:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewalds_multipole.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewalds_multipole.F90 +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:600:46: - 106 | ldsab, lppnl, maxco, maxder, maxl, maxlgto, maxlppnl, maxppnl, maxsgf, na, natom, nb, & - | ^ -Warning: 'natom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:76: + 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) + | ^ +Warning: 'tij' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:555:107: - 131 | REAL(KIND=dp), DIMENSION(:), POINTER :: a_nl, alpha_ppnl, hprj, set_radius_a - | ^ -Warning: 'alpha_ppnl.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:76: Warning: 'alpha_ppnl.span' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:76: Warning: 'alpha_ppnl.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:76: Warning: 'alpha_ppnl.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:110:92: + 555 | ptens12, ptens13, ptens21, ptens22, ptens23, ptens31, ptens32, ptens33, r, rab2, tij, & + | ^ +note: 'tij' was declared here +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:554:40: - 110 | INTEGER, DIMENSION(:), POINTER :: la_max, la_min, npgfa, nprj_ppnl, & - | ^ -Warning: 'nprj_ppnl.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:110:92: Warning: 'nprj_ppnl.span' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:110:92: Warning: 'nprj_ppnl.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:110:92: Warning: 'nprj_ppnl.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:130:77: + 554 | REAL(KIND=dp) :: alpha, ch_i, ch_j, ef0_i, ef0_j, eloc, fac, fac_ij, ir, irab2, ptens11, & + | ^ +Warning: 'ch_j' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:554:34: - 130 | sphi_a, vprj_ppnl, zeta - | ^ -Warning: 'vprj_ppnl.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:130:77: Warning: 'vprj_ppnl.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:130:77: Warning: 'vprj_ppnl.span' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:130:77: Warning: 'vprj_ppnl.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:130:77: Warning: 'vprj_ppnl.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:82: + 554 | REAL(KIND=dp) :: alpha, ch_i, ch_j, ef0_i, ef0_j, eloc, fac, fac_ij, ir, irab2, ptens11, & + | ^ +Warning: 'ch_i' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:481:46: - 131 | REAL(KIND=dp), DIMENSION(:), POINTER :: a_nl, alpha_ppnl, hprj, set_radius_a - | ^ -Warning: 'hprj.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:82: Warning: 'hprj.span' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:82: Warning: 'hprj.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:82: Warning: 'hprj.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:401:111: + 481 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_GAUSS", damping=False, store_energy=True, store_forces=True) + | ^ +Warning: 'tij' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:382:32: - 401 | work(1:np, 1:nb) = MATMUL(sab(1:np, first_col:first_col + nprjc - 1), cprj(1:nprjc, 1:nb)) - | ^ -Warning: 'nprjc' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:107:67: + 382 | rcut, tij, tmp, tmp1, tmp11, tmp12, tmp13, tmp2, tmp21, tmp22, tmp23, tmp31, tmp32, & + | ^ +note: 'tij' was declared here +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:378:46: - 107 | ncoa, ncoc, nkind, nlist, nneighbor, nnl, np, nppnl, nprjc, nseta, nsgfa, prjc, sgfa, slot - | ^ -note: 'nprjc' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'core_ppnl.mod' due to: core_ppnl.o /build/reproducible-path/cp2k-8.1/src/core_ppnl.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod external_potential_types.mod qs_neighbor_list_types.mod sap_kind_types.mod ai_overlap.mod base_hooks.mod virial_methods.mod orbital_pointers.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_verfc.mod' due to: ai_verfc.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'core_ae.o' due to: /build/reproducible-path/cp2k-8.1/src/core_ae.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod external_potential_types.mod qs_neighbor_list_types.mod base_hooks.mod virial_methods.mod orbital_pointers.mod ai_verfc.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/core_ae.F core_ae.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:40:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"core_ae.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' core_ae.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'core_ae.mod' due to: core_ae.o /build/reproducible-path/cp2k-8.1/src/core_ae.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod external_potential_types.mod qs_neighbor_list_types.mod base_hooks.mod virial_methods.mod orbital_pointers.mod ai_verfc.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_kinetic.mod' due to: ai_kinetic.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_kinetic.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_kinetic.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod virial_types.mod cp_control_types.mod atomic_kind_types.mod qs_force_types.mod qs_ks_types.mod kinds.mod ai_kinetic.mod virial_methods.mod cp_dbcsr_operations.mod ai_contraction.mod qs_integral_utils.mod qs_overlap.mod base_hooks.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_kinetic.F qs_kinetic.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:40:10 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_kinetic.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_kinetic.F90 -/build/reproducible-path/cp2k-8.1/src/qs_kinetic.F:165:95: + 378 | REAL(KIND=dp) :: alpha, beta, ch_i, ch_j, dampa_ij, dampa_ji, dampaexpi, dampaexpj, & + | ^ +Warning: 'ch_j' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:378:40: - 165 | trans, use_cell_mapping, use_virial - | ^ -Warning: 'use_virial' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_kinetic.F:264:46: + 378 | REAL(KIND=dp) :: alpha, beta, ch_i, ch_j, dampa_ij, dampa_ji, dampaexpi, dampaexpj, & + | ^ +Warning: 'ch_i' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:600:75: - 264 | !$OMP REDUCTION (+ : pv_thread, force_thread ) - | ^ -Warning: 'use_cell_mapping' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_kinetic.F:164:89: + 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) + | ^ +Warning: 'efield2_sr.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:161:70: - 164 | LOGICAL :: do_forces, do_symmetric, dokp, found, & - | ^ -Warning: 'dokp' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_kinetic.mod' due to: qs_kinetic.o /build/reproducible-path/cp2k-8.1/src/qs_kinetic.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod virial_types.mod cp_control_types.mod atomic_kind_types.mod qs_force_types.mod qs_ks_types.mod kinds.mod ai_kinetic.mod virial_methods.mod cp_dbcsr_operations.mod ai_contraction.mod qs_integral_utils.mod qs_overlap.mod base_hooks.mod orbital_pointers.mod + 161 | efield2_sr + | ^ +note: 'efield2_sr.dim[1].stride' was declared here +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:600:75: + + 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) + | ^ +Warning: 'efield2_sr.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:161:70: + + 161 | efield2_sr + | ^ +note: 'efield2_sr.offset' was declared here +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:600:72: + + 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) + | ^ +Warning: 'efield1_sr.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:160:82: + + 160 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: efield1_lr, efield1_sr, efield2_lr, & + | ^ +note: 'efield1_sr.dim[1].stride' was declared here +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:600:72: + + 600 | $: ewalds_multipole_sr_macro(mode="SCREENED_COULOMB_ERF", store_energy=True, store_forces=True) + | ^ +Warning: 'efield1_sr.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F:160:82: + + 160 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: efield1_lr, efield1_sr, efield2_lr, & + | ^ +note: 'efield1_sr.offset' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewalds_multipole.mod' due to: ewalds_multipole.o /build/reproducible-path/cp2k-8.1/src/ewalds_multipole.F /build/reproducible-path/cp2k-8.1/src/ewalds_multipole_sr.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod cell_types.mod parallel_rng_types.mod dg_rho0_types.mod fist_nonbond_env_types.mod damping_dipole_types.mod atomic_kind_types.mod pw_grid_types.mod ewald_environment_types.mod distribution_1d_types.mod dg_types.mod input_section_types.mod ewald_pw_types.mod structure_factor_types.mod fist_neighbor_list_types.mod cp_log_handling.mod kinds.mod bibliography.mod message_passing.mod structure_factors.mod fist_neighbor_list_control.mod mathlib.mod base_hooks.mod mathconstants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_core_hamiltonian.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_core_hamiltonian.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod lri_environment_types.mod qs_oce_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod kg_environment_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod input_constants.mod cp_blacs_env.mod kg_tnadd_mat.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod core_ppl.mod qs_condnum.mod qs_oce_methods.mod cp_dbcsr_cp2k_link.mod core_ppnl.mod qs_overlap.mod core_ae.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod qs_kinetic.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_core_hamiltonian.F qs_core_hamiltonian.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:40:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_core_hamiltonian.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_core_hamiltonian.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_core_hamiltonian.mod' due to: qs_core_hamiltonian.o /build/reproducible-path/cp2k-8.1/src/qs_core_hamiltonian.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod lri_environment_types.mod qs_oce_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod kg_environment_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod input_constants.mod cp_blacs_env.mod kg_tnadd_mat.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod core_ppl.mod qs_condnum.mod qs_oce_methods.mod cp_dbcsr_cp2k_link.mod core_ppnl.mod qs_overlap.mod core_ae.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod qs_kinetic.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_fock_matrix_coulomb.o' due to: /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_coulomb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod particle_types.mod cell_types.mod qs_force_types.mod pw_poisson_types.mod atprop_types.mod semi_empirical_store_int_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod virial_types.mod ewald_pw_types.mod semi_empirical_mpole_types.mod cp_control_types.mod qs_energy_types.mod multipole_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod se_fock_matrix_integrals.mod semi_empirical_mpole_methods.mod virial_methods.mod cp_dbcsr_operations.mod message_passing.mod fist_neighbor_list_control.mod semi_empirical_utils.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod base_hooks.mod input_constants.mod ewalds_multipole.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_coulomb.F se_fock_matrix_coulomb.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:52:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix_coulomb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix_coulomb.F90 +/build/reproducible-path/cp2k-8.1/src/se_fock_matrix_coulomb.F:688:46: + + 688 | ALLOCATE (forces_g(3, forces_g_size)) + | ^ +Warning: 'forces_g_size' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_fock_matrix_coulomb.mod' due to: se_fock_matrix_coulomb.o /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_coulomb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod particle_types.mod cell_types.mod qs_force_types.mod pw_poisson_types.mod atprop_types.mod semi_empirical_store_int_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod virial_types.mod ewald_pw_types.mod semi_empirical_mpole_types.mod cp_control_types.mod qs_energy_types.mod multipole_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod se_fock_matrix_integrals.mod semi_empirical_mpole_methods.mod virial_methods.mod cp_dbcsr_operations.mod message_passing.mod fist_neighbor_list_control.mod semi_empirical_utils.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod base_hooks.mod input_constants.mod ewalds_multipole.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_update_s_mstruct.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_update_s_mstruct.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod qs_scf_types.mod cp_ddapc_types.mod qs_environment_types.mod cp_control_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod task_list_methods.mod qs_rho_methods.mod pw_methods.mod base_hooks.mod cp_ddapc_util.mod qs_collocate_density.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_update_s_mstruct.F qs_update_s_mstruct.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:40:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_update_s_mstruct.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_update_s_mstruct.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_update_s_mstruct.mod' due to: qs_update_s_mstruct.o /build/reproducible-path/cp2k-8.1/src/qs_update_s_mstruct.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod qs_scf_types.mod cp_ddapc_types.mod qs_environment_types.mod cp_control_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod task_list_methods.mod qs_rho_methods.mod pw_methods.mod base_hooks.mod cp_ddapc_util.mod qs_collocate_density.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_fock_matrix_dbg.o' due to: /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_dbg.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod semi_empirical_store_int_types.mod qs_energy_types.mod se_fock_matrix_coulomb.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_dbg.F se_fock_matrix_dbg.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:52:29 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix_dbg.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix_dbg.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_fock_matrix_dbg.mod' due to: se_fock_matrix_dbg.o /build/reproducible-path/cp2k-8.1/src/se_fock_matrix_dbg.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod semi_empirical_store_int_types.mod qs_energy_types.mod se_fock_matrix_coulomb.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_energy_matrix_w.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_energy_matrix_w.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod scf_control_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cp_control_types.mod kpoint_types.mod cp_fm_types.mod kpoint_methods.mod qs_ks_methods.mod base_hooks.mod cp_fm_struct.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_energy_matrix_w.F qs_energy_matrix_w.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:40:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_matrix_w.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_matrix_w.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_energy_matrix_w.mod' due to: qs_energy_matrix_w.o /build/reproducible-path/cp2k-8.1/src/qs_energy_matrix_w.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod scf_control_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cp_control_types.mod kpoint_types.mod cp_fm_types.mod kpoint_methods.mod qs_ks_methods.mod base_hooks.mod cp_fm_struct.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_fock_matrix.o' due to: /build/reproducible-path/cp2k-8.1/src/se_fock_matrix.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod atprop_types.mod semi_empirical_store_int_types.mod atomic_kind_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod se_fock_matrix_exchange.mod cp_output_handling.mod se_fock_matrix_dbg.mod se_fock_matrix_coulomb.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_fock_matrix.F se_fock_matrix.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:52:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_fock_matrix.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_fock_matrix.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_fock_matrix.mod' due to: se_fock_matrix.o /build/reproducible-path/cp2k-8.1/src/se_fock_matrix.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod atprop_types.mod semi_empirical_store_int_types.mod atomic_kind_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod se_fock_matrix_exchange.mod cp_output_handling.mod se_fock_matrix_dbg.mod se_fock_matrix_coulomb.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_basis_gradient.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_basis_gradient.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_subsys_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod qs_mixing_utils.mod qs_ks_methods.mod qs_rho_methods.mod kinds.mod qs_core_hamiltonian.mod qs_update_s_mstruct.mod cp_dbcsr_operations.mod qs_energy_matrix_w.mod cp_log_handling.mod base_hooks.mod qs_neighbor_lists.mod qs_mo_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_basis_gradient.F qs_basis_gradient.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:40:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_basis_gradient.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_basis_gradient.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_basis_gradient.mod' due to: qs_basis_gradient.o /build/reproducible-path/cp2k-8.1/src/qs_basis_gradient.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_subsys_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod qs_mixing_utils.mod qs_ks_methods.mod qs_rho_methods.mod kinds.mod qs_core_hamiltonian.mod qs_update_s_mstruct.mod cp_dbcsr_operations.mod qs_energy_matrix_w.mod cp_log_handling.mod base_hooks.mod qs_neighbor_lists.mod qs_mo_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ks_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ks_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod cell_types.mod qs_cdft_types.mod qs_charges_types.mod admm_types.mod qs_mo_types.mod pw_poisson_types.mod cp_fm_types.mod qs_local_rho_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod hartree_local_types.mod pw_types.mod input_section_types.mod qs_rho_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod lri_environment_types.mod qs_vxc_atom.mod cp_log_handling.mod dft_plus_u.mod hfx_admm_utils.mod kinds.mod xtb_matrices.mod cp_gemm_interface.mod qs_integrate_potential.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod qs_ks_qmmm_methods.mod qs_rho0_ggrid.mod qs_dftb_matrices.mod cp_fm_struct.mod qs_ks_apply_restraints.mod qs_ks_atom.mod qs_ks_utils.mod cp_dbcsr_operations.mod message_passing.mod rtp_admm_methods.mod qs_efield_berry.mod qmmm_image_charge.mod hartree_local_methods.mod qs_efield_local.mod pw_poisson_methods.mod qs_vxc.mod cp_fm_basic_linalg.mod cp_ddapc.mod mathlib.mod qs_core_energies.mod pw_methods.mod qs_sccs.mod cp_blacs_env.mod lri_environment_methods.mod qs_gapw_densities.mod admm_dm_methods.mod base_hooks.mod kg_correction.mod surface_dipole.mod efield_utils.mod input_constants.mod se_fock_matrix.mod admm_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ks_methods.F qs_ks_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:52:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ks_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ks_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ks_methods.mod' due to: qs_ks_methods.o /build/reproducible-path/cp2k-8.1/src/qs_ks_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod cell_types.mod qs_cdft_types.mod qs_charges_types.mod admm_types.mod qs_mo_types.mod pw_poisson_types.mod cp_fm_types.mod qs_local_rho_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod hartree_local_types.mod pw_types.mod input_section_types.mod qs_rho_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod lri_environment_types.mod qs_vxc_atom.mod cp_log_handling.mod dft_plus_u.mod hfx_admm_utils.mod kinds.mod xtb_matrices.mod cp_gemm_interface.mod qs_integrate_potential.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod qs_ks_qmmm_methods.mod qs_rho0_ggrid.mod qs_dftb_matrices.mod cp_fm_struct.mod qs_ks_apply_restraints.mod qs_ks_atom.mod qs_ks_utils.mod cp_dbcsr_operations.mod message_passing.mod rtp_admm_methods.mod qs_efield_berry.mod qmmm_image_charge.mod hartree_local_methods.mod qs_efield_local.mod pw_poisson_methods.mod qs_vxc.mod cp_fm_basic_linalg.mod cp_ddapc.mod mathlib.mod qs_core_energies.mod pw_methods.mod qs_sccs.mod cp_blacs_env.mod lri_environment_methods.mod qs_gapw_densities.mod admm_dm_methods.mod base_hooks.mod kg_correction.mod surface_dipole.mod efield_utils.mod input_constants.mod se_fock_matrix.mod admm_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_outer_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_cdft_opt_types.mod scf_control_types.mod qs_cdft_types.mod qs_scf_types.mod qs_environment_types.mod cp_control_types.mod qs_energy_types.mod input_constants.mod mathlib.mod cp_log_handling.mod qs_basis_gradient.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F qs_outer_scf.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:40:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_outer_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_outer_scf.F90 -/build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F:511:60: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_active_space_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_active_space_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod pw_poisson_types.mod particle_list_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod qs_energy_types.mod task_list_types.mod cp_log_handling.mod kinds.mod cp_fm_vect.mod cp_gemm_interface.mod qs_loc_methods.mod cp_output_handling.mod periodic_table.mod cp_fm_struct.mod pw_env_methods.mod cp_dbcsr_operations.mod message_passing.mod cp_realspace_grid_cube.mod qs_mo_methods.mod pw_poisson_methods.mod task_list_methods.mod qs_collocate_density.mod qs_ks_methods.mod cp_fm_basic_linalg.mod memory_utilities.mod cp_files.mod pw_methods.mod qs_loc_utils.mod base_hooks.mod mathconstants.mod cp_fm_diag.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F qs_active_space_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:52:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_active_space_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_active_space_methods.F90 +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1179:82: - 511 | ddapc_restraint_control%strength = extrapolation(1) - | ^ -Warning: 'ddapc_restraint_control' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F:415:88: + 1179 | wfn_r%pw%cr3d = rho_r%pw%cr3d*wfn3%pw%cr3d*wfn4%pw%cr3d + | ^ +Warning: 'wfn4' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:981:82: - 415 | ddapc_restraint_control%strength = scf_env%outer_scf%variables(1, ihistory + 1) - | ^ -Warning: 'ddapc_restraint_control' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F:141:17: + 981 | TYPE(pw_p_type), POINTER :: wfn1, wfn2, wfn3, wfn4 + | ^ +note: 'wfn4' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1179:82: - 141 | CPASSERT(is_constraint) - | ^ -Warning: 'is_constraint' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F:145:81: + 1179 | wfn_r%pw%cr3d = rho_r%pw%cr3d*wfn3%pw%cr3d*wfn4%pw%cr3d + | ^ +Warning: 'wfn3' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:981:76: - 145 | ddapc_restraint_control%target - | ^ -Warning: 'ddapc_restraint_control' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_outer_scf.mod' due to: qs_outer_scf.o /build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_cdft_opt_types.mod scf_control_types.mod qs_cdft_types.mod qs_scf_types.mod qs_environment_types.mod cp_control_types.mod qs_energy_types.mod input_constants.mod mathlib.mod cp_log_handling.mod qs_basis_gradient.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_environment_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_environment_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod qs_kind_types.mod distribution_2d_types.mod cp_para_types.mod qs_rho0_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod molecule_kind_types.mod pw_pool_types.mod atomic_kind_types.mod scf_control_types.mod ewald_pw_types.mod qs_charges_types.mod ewald_environment_types.mod qs_ks_types.mod molecule_types.mod input_constants.mod cp_blacs_env.mod distribution_methods.mod pw_env_methods.mod qs_matrix_pools.mod kinds.mod ewald_pw_methods.mod cp_dbcsr_operations.mod qs_outer_scf.mod qs_rho0_ggrid.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_environment_methods.F qs_environment_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:40:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_environment_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_environment_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_environment_methods.mod' due to: qs_environment_methods.o /build/reproducible-path/cp2k-8.1/src/qs_environment_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod qs_kind_types.mod distribution_2d_types.mod cp_para_types.mod qs_rho0_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod molecule_kind_types.mod pw_pool_types.mod atomic_kind_types.mod scf_control_types.mod ewald_pw_types.mod qs_charges_types.mod ewald_environment_types.mod qs_ks_types.mod molecule_types.mod input_constants.mod cp_blacs_env.mod distribution_methods.mod pw_env_methods.mod qs_matrix_pools.mod kinds.mod ewald_pw_methods.mod cp_dbcsr_operations.mod qs_outer_scf.mod qs_rho0_ggrid.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kg_vertex_coloring_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kg_environment_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod bibliography.mod kinds.mod cp_min_heap.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F kg_vertex_coloring_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:40:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_vertex_coloring_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_vertex_coloring_methods.F90 -/build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F:201:54: + 981 | TYPE(pw_p_type), POINTER :: wfn1, wfn2, wfn3, wfn4 + | ^ +note: 'wfn3' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1142:56: - 201 | IF (newcolor .GT. ncolors) ncolors = newcolor - | ^ -Warning: 'newcolor' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F:174:89: + 1142 | rho_r%pw%cr3d = wfn1%pw%cr3d*wfn2%pw%cr3d + | ^ +Warning: 'wfn2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:981:70: - 174 | INTEGER :: color, handle, i, j, newcolor, & - | ^ -note: 'newcolor' was declared here -/build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F:120:36: + 981 | TYPE(pw_p_type), POINTER :: wfn1, wfn2, wfn3, wfn4 + | ^ +note: 'wfn2' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1142:56: - 120 | nneighbors = nneighbors + 1 - | ^ -Warning: 'nneighbors' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F:77:81: + 1142 | rho_r%pw%cr3d = wfn1%pw%cr3d*wfn2%pw%cr3d + | ^ +Warning: 'wfn1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:981:64: - 77 | maxdegree, nneighbors, nnodes - | ^ -note: 'nneighbors' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kg_vertex_coloring_methods.mod' due to: kg_vertex_coloring_methods.o /build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kg_environment_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod bibliography.mod kinds.mod cp_min_heap.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kg_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/kg_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod kg_environment_types.mod external_potential_types.mod distribution_1d_types.mod integration_grid_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod task_list_types.mod input_constants.mod string_utilities.mod cp_files.mod util.mod kinds.mod lri_environment_init.mod kg_vertex_coloring_methods.mod message_passing.mod bibliography.mod qs_grid_atom.mod cp_log_handling.mod base_hooks.mod qs_neighbor_lists.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kg_environment.F kg_environment.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:40:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_environment.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kg_environment.mod' due to: kg_environment.o /build/reproducible-path/cp2k-8.1/src/kg_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod kg_environment_types.mod external_potential_types.mod distribution_1d_types.mod integration_grid_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod task_list_types.mod input_constants.mod string_utilities.mod cp_files.mod util.mod kinds.mod lri_environment_init.mod kg_vertex_coloring_methods.mod message_passing.mod bibliography.mod qs_grid_atom.mod cp_log_handling.mod base_hooks.mod qs_neighbor_lists.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_setup.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_setup.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod input_section_types.mod input_constants.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod kinds.mod cp_eri_mme_interface.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_setup.F mp2_setup.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:40:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_setup.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_setup.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_setup.mod' due to: mp2_setup.o /build/reproducible-path/cp2k-8.1/src/mp2_setup.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod input_section_types.mod input_constants.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod kinds.mod cp_eri_mme_interface.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_wf_history_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_wf_history_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_rho_types.mod pw_types.mod qs_mo_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod pw_pool_types.mod qs_scf_types.mod cp_fm_types.mod scf_control_types.mod qs_wf_history_types.mod qs_ks_types.mod input_constants.mod pw_methods.mod cp_gemm_interface.mod cp_fm_struct.mod qs_matrix_pools.mod qs_rho_methods.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod bibliography.mod mathlib.mod cp_log_handling.mod base_hooks.mod qs_mo_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_wf_history_methods.F qs_wf_history_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:40:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_wf_history_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_wf_history_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_wf_history_methods.mod' due to: qs_wf_history_methods.o /build/reproducible-path/cp2k-8.1/src/qs_wf_history_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_rho_types.mod pw_types.mod qs_mo_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod pw_pool_types.mod qs_scf_types.mod cp_fm_types.mod scf_control_types.mod qs_wf_history_types.mod qs_ks_types.mod input_constants.mod pw_methods.mod cp_gemm_interface.mod cp_fm_struct.mod qs_matrix_pools.mod qs_rho_methods.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod bibliography.mod mathlib.mod cp_log_handling.mod base_hooks.mod qs_mo_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_gcp_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_gcp_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod input_section_types.mod qs_kind_types.mod qs_gcp_types.mod qs_environment_types.mod cp_parser_types.mod periodic_table.mod base_hooks.mod mathconstants.mod sto_ng.mod kinds.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_gcp_utils.F qs_gcp_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:40:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gcp_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gcp_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_gcp_utils.mod' due to: qs_gcp_utils.o /build/reproducible-path/cp2k-8.1/src/qs_gcp_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod input_section_types.mod qs_kind_types.mod qs_gcp_types.mod qs_environment_types.mod cp_parser_types.mod periodic_table.mod base_hooks.mod mathconstants.mod sto_ng.mod kinds.mod cp_parser_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molsym.o' due to: /build/reproducible-path/cp2k-8.1/src/molsym.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod mathlib.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/molsym.F molsym.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:41:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molsym.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molsym.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molsym.mod' due to: molsym.o /build/reproducible-path/cp2k-8.1/src/molsym.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod mathlib.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_symmetry.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_symmetry.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod input_section_types.mod cell_types.mod particle_types.mod string_utilities.mod cryssym.mod molsym.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_symmetry.F cp_symmetry.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:41:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_symmetry.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_symmetry.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_symmetry.mod' due to: cp_symmetry.o /build/reproducible-path/cp2k-8.1/src/cp_symmetry.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod input_section_types.mod cell_types.mod particle_types.mod string_utilities.mod cryssym.mod molsym.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'preconditioner_makes.o' due to: /build/reproducible-path/cp2k-8.1/src/preconditioner_makes.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod cp_fm_types.mod input_constants.mod arnoldi_api.mod base_hooks.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_fm_cholesky.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/preconditioner_makes.F preconditioner_makes.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:41:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner_makes.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner_makes.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'preconditioner_makes.mod' due to: preconditioner_makes.o /build/reproducible-path/cp2k-8.1/src/preconditioner_makes.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod cp_fm_types.mod input_constants.mod arnoldi_api.mod base_hooks.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_fm_cholesky.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'preconditioner_apply.o' due to: /build/reproducible-path/cp2k-8.1/src/preconditioner_apply.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod cp_gemm_interface.mod cp_fm_cholesky.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/preconditioner_apply.F preconditioner_apply.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:41:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner_apply.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner_apply.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'preconditioner_apply.mod' due to: preconditioner_apply.o /build/reproducible-path/cp2k-8.1/src/preconditioner_apply.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod cp_gemm_interface.mod cp_fm_cholesky.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'preconditioner_solvers.o' due to: /build/reproducible-path/cp2k-8.1/src/preconditioner_solvers.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod cp_fm_types.mod input_constants.mod arnoldi_api.mod base_hooks.mod iterate_matrix.mod cp_fm_struct.mod bibliography.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/preconditioner_solvers.F preconditioner_solvers.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:41:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner_solvers.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner_solvers.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'preconditioner_solvers.mod' due to: preconditioner_solvers.o /build/reproducible-path/cp2k-8.1/src/preconditioner_solvers.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod cp_fm_types.mod input_constants.mod arnoldi_api.mod base_hooks.mod iterate_matrix.mod cp_fm_struct.mod bibliography.mod cp_fm_cholesky.mod cp_blacs_env.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'preconditioner.o' due to: /build/reproducible-path/cp2k-8.1/src/preconditioner.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod cp_para_types.mod qs_mo_types.mod preconditioner_types.mod qs_environment_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod preconditioner_makes.mod preconditioner_apply.mod preconditioner_solvers.mod cp_blacs_env.mod cp_dbcsr_operations.mod qs_mo_methods.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/preconditioner.F preconditioner.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:41:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"preconditioner.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' preconditioner.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'preconditioner.mod' due to: preconditioner.o /build/reproducible-path/cp2k-8.1/src/preconditioner.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod cp_para_types.mod qs_mo_types.mod preconditioner_types.mod qs_environment_types.mod cp_fm_types.mod input_constants.mod base_hooks.mod preconditioner_makes.mod preconditioner_apply.mod preconditioner_solvers.mod cp_blacs_env.mod cp_dbcsr_operations.mod qs_mo_methods.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ot.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ot.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod qs_ot_types.mod arnoldi_api.mod base_hooks.mod message_passing.mod preconditioner.mod cp_dbcsr_cholesky.mod cp_dbcsr_diag.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ot.F qs_ot.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:41:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ot.mod' due to: qs_ot.o /build/reproducible-path/cp2k-8.1/src/qs_ot.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod qs_ot_types.mod arnoldi_api.mod base_hooks.mod message_passing.mod preconditioner.mod cp_dbcsr_cholesky.mod cp_dbcsr_diag.mod kinds.mod + 981 | TYPE(pw_p_type), POINTER :: wfn1, wfn2, wfn3, wfn4 + | ^ +note: 'wfn1' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:980:65: + + 980 | TYPE(pw_p_type), DIMENSION(:, :), POINTER :: wfn_a + | ^ +Warning: 'wfn_a.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:980:65: Warning: 'wfn_a.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:980:65: Warning: 'wfn_a.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1100:31: + + 1100 | IF (print2 .AND. iw > 0) THEN + | ^ +Warning: 'print2' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:965:74: + + 965 | LOGICAL :: print1, print2, & + | ^ +note: 'print2' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1205:22: + + 1205 | IF (print1 .AND. iw > 0) THEN + | ^ +Warning: 'print1' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:965:66: + + 965 | LOGICAL :: print1, print2, & + | ^ +note: 'print1' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1996:65: + + 1996 | ALLOCATE (nq(ishell), lq(ishell), zet(ishell), sym(ishell)) + | ^ +Warning: 'ishell' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:187:78: + + 187 | INTEGER :: eri_method, eri_operator, eri_print, handle, i, iatom, ishell, isp, ispin, iw, j, & + | ^ +note: 'ishell' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_active_space_methods.mod' due to: qs_active_space_methods.o /build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_active_space_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod pw_poisson_types.mod particle_list_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod qs_energy_types.mod task_list_types.mod cp_log_handling.mod kinds.mod cp_fm_vect.mod cp_gemm_interface.mod qs_loc_methods.mod cp_output_handling.mod periodic_table.mod cp_fm_struct.mod pw_env_methods.mod cp_dbcsr_operations.mod message_passing.mod cp_realspace_grid_cube.mod qs_mo_methods.mod pw_poisson_methods.mod task_list_methods.mod qs_collocate_density.mod qs_ks_methods.mod cp_fm_basic_linalg.mod memory_utilities.mod cp_files.mod pw_methods.mod qs_loc_utils.mod base_hooks.mod mathconstants.mod cp_fm_diag.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ot_minimizer.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ot_minimizer.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod mathlib.mod cp_log_handling.mod base_hooks.mod preconditioner.mod qs_ot.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ot_minimizer.F qs_ot_minimizer.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:41:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot_minimizer.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot_minimizer.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ot_minimizer.mod' due to: qs_ot_minimizer.o /build/reproducible-path/cp2k-8.1/src/qs_ot_minimizer.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ot_types.mod mathlib.mod cp_log_handling.mod base_hooks.mod preconditioner.mod qs_ot.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_mo_types.mod qs_density_mixing_types.mod cp_fm_types.mod message_passing.mod kinds.mod cp_fm_diag.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod cp_fm_cholesky.mod cp_fm_struct.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_methods.F qs_scf_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:53:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_methods.mod' due to: qs_scf_methods.o /build/reproducible-path/cp2k-8.1/src/qs_scf_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_mo_types.mod qs_density_mixing_types.mod cp_fm_types.mod message_passing.mod kinds.mod cp_fm_diag.mod base_hooks.mod cp_gemm_interface.mod input_constants.mod cp_fm_cholesky.mod cp_fm_struct.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ot_eigensolver.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ot_eigensolver.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod qs_ot_types.mod cp_fm_types.mod cp_log_handling.mod base_hooks.mod cp_dbcsr_cholesky.mod qs_ot.mod qs_mo_methods.mod cp_dbcsr_operations.mod qs_ot_minimizer.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ot_eigensolver.F qs_ot_eigensolver.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:41:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot_eigensolver.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot_eigensolver.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ot_eigensolver.mod' due to: qs_ot_eigensolver.o /build/reproducible-path/cp2k-8.1/src/qs_ot_eigensolver.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 preconditioner_types.mod qs_ot_types.mod cp_fm_types.mod cp_log_handling.mod base_hooks.mod cp_dbcsr_cholesky.mod qs_ot.mod qs_mo_methods.mod cp_dbcsr_operations.mod qs_ot_minimizer.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mixing_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mixing_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_density_mixing_types.mod cp_control_types.mod pw_types.mod qs_rho_atom_types.mod qs_rho_types.mod distribution_1d_types.mod message_passing.mod kinds.mod base_hooks.mod cp_dbcsr_cp2k_link.mod qs_scf_methods.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_mixing_utils.F qs_mixing_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:53:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mixing_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mixing_utils.F90 +/build/reproducible-path/cp2k-8.1/src/qs_mixing_utils.F:125:80: + + 125 | max_shell, na, natom, nbuffer, nel, & + | ^ +Warning: 'natom' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mixing_utils.F:233:39: + + 233 | mixing_store%ubroy = 0.0_dp + | ^ +Warning: 'na' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_mixing_utils.F:229:66: + + 229 | ALLOCATE (mixing_store%dfbroy(na, max_shell, nbuffer)) + | ^ +Warning: 'max_shell' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mixing_utils.mod' due to: qs_mixing_utils.o /build/reproducible-path/cp2k-8.1/src/qs_mixing_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_density_mixing_types.mod cp_control_types.mod pw_types.mod qs_rho_atom_types.mod qs_rho_types.mod distribution_1d_types.mod message_passing.mod kinds.mod base_hooks.mod cp_dbcsr_cp2k_link.mod qs_scf_methods.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_lanczos.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_lanczos.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod qs_scf_types.mod qs_mo_types.mod cp_fm_types.mod cp_log_handling.mod message_passing.mod cp_gemm_interface.mod base_hooks.mod cp_fm_diag.mod cp_fm_struct.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_lanczos.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_lanczos.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_mo_types.mod scf_control_types.mod cp_fm_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_fm_diag.mod cp_gemm_interface.mod cp_fm_cholesky.mod cp_fm_struct.mod cp_fm_basic_linalg.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_lanczos.F qs_scf_lanczos.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:41:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_lanczos.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_lanczos.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_lanczos.mod' due to: qs_scf_lanczos.o /build/reproducible-path/cp2k-8.1/src/qs_scf_lanczos.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod qs_scf_types.mod qs_mo_types.mod cp_fm_types.mod cp_log_handling.mod message_passing.mod cp_gemm_interface.mod base_hooks.mod cp_fm_diag.mod cp_fm_struct.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:53:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_lanczos.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_lanczos.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_lanczos.mod' due to: qs_scf_lanczos.o /build/reproducible-path/cp2k-8.1/src/qs_scf_lanczos.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_scf_types.mod qs_mo_types.mod scf_control_types.mod cp_fm_types.mod message_passing.mod cp_log_handling.mod kinds.mod cp_fm_diag.mod cp_gemm_interface.mod cp_fm_cholesky.mod cp_fm_struct.mod cp_fm_basic_linalg.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_block_davidson.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_block_davidson.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_block_davidson_types.mod preconditioner_types.mod qs_mo_types.mod cp_fm_types.mod machine.mod base_hooks.mod message_passing.mod cp_gemm_interface.mod preconditioner.mod cp_fm_diag.mod cp_fm_struct.mod cp_fm_cholesky.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_block_davidson.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_block_davidson.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_block_davidson_types.mod qs_mo_types.mod preconditioner_types.mod cp_fm_types.mod message_passing.mod preconditioner.mod kinds.mod cp_fm_diag.mod base_hooks.mod cp_gemm_interface.mod cp_fm_cholesky.mod cp_fm_struct.mod machine.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_block_davidson.F qs_scf_block_davidson.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:41:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_block_davidson.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_block_davidson.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:53:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_block_davidson.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_block_davidson.F90 /build/reproducible-path/cp2k-8.1/src/qs_scf_block_davidson.F:884:43: 884 | i_first = inotconv_set(j, 1) @@ -43823,16 +43956,16 @@ 885 | i_last = inotconv_set(j, 2) | ^ Warning: 'inotconv_set.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_block_davidson.mod' due to: qs_scf_block_davidson.o /build/reproducible-path/cp2k-8.1/src/qs_scf_block_davidson.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_block_davidson_types.mod preconditioner_types.mod qs_mo_types.mod cp_fm_types.mod machine.mod base_hooks.mod message_passing.mod cp_gemm_interface.mod preconditioner.mod cp_fm_diag.mod cp_fm_struct.mod cp_fm_cholesky.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_block_davidson.mod' due to: qs_scf_block_davidson.o /build/reproducible-path/cp2k-8.1/src/qs_scf_block_davidson.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_block_davidson_types.mod qs_mo_types.mod preconditioner_types.mod cp_fm_types.mod message_passing.mod preconditioner.mod kinds.mod cp_fm_diag.mod base_hooks.mod cp_gemm_interface.mod cp_fm_cholesky.mod cp_fm_struct.mod machine.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_diis.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_diis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod cp_para_types.mod input_section_types.mod qs_mo_types.mod qs_environment_types.mod qs_diis_types.mod cp_fm_types.mod string_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_gemm_interface.mod cp_fm_struct.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_diis.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_diis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_mo_types.mod dm_ls_scf_types.mod qs_diis_types.mod cp_fm_types.mod input_section_types.mod mathlib.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_gemm_interface.mod cp_output_handling.mod string_utilities.mod cp_fm_struct.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_diis.F qs_diis.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:41:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_diis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_diis.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_diis.mod' due to: qs_diis.o /build/reproducible-path/cp2k-8.1/src/qs_diis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod cp_para_types.mod input_section_types.mod qs_mo_types.mod qs_environment_types.mod qs_diis_types.mod cp_fm_types.mod string_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_gemm_interface.mod cp_fm_struct.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:53:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_diis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_diis.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_diis.mod' due to: qs_diis.o /build/reproducible-path/cp2k-8.1/src/qs_diis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_mo_types.mod dm_ls_scf_types.mod qs_diis_types.mod cp_fm_types.mod input_section_types.mod mathlib.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_gemm_interface.mod cp_output_handling.mod string_utilities.mod cp_fm_struct.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_gspace_mixing.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_gspace_mixing.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cp_para_types.mod pw_types.mod pw_pool_types.mod pw_env_types.mod qs_density_mixing_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod mathlib.mod pw_methods.mod message_passing.mod base_hooks.mod kinds.mod qs_scf_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_gspace_mixing.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_gspace_mixing.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod pw_env_types.mod qs_density_mixing_types.mod pw_pool_types.mod cp_control_types.mod pw_types.mod qs_rho_atom_types.mod qs_rho_types.mod mathlib.mod message_passing.mod kinds.mod pw_methods.mod base_hooks.mod qs_scf_methods.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_gspace_mixing.F qs_gspace_mixing.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:41:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gspace_mixing.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gspace_mixing.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:53:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gspace_mixing.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gspace_mixing.F90 /build/reproducible-path/cp2k-8.1/src/qs_gspace_mixing.F:713:106: 713 | mixing_store%res_buffer(ib, ispin)%cc(:) = mixing_store%res_buffer(ib, ispin)%cc(:)/delta_norm @@ -43868,46 +44001,62 @@ 897 | kb, kkb, lwork, nb, nbuffer, ng, nspin | ^ Warning: 'nb' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_gspace_mixing.mod' due to: qs_gspace_mixing.o /build/reproducible-path/cp2k-8.1/src/qs_gspace_mixing.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cp_para_types.mod pw_types.mod pw_pool_types.mod pw_env_types.mod qs_density_mixing_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod mathlib.mod pw_methods.mod message_passing.mod base_hooks.mod kinds.mod qs_scf_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_gspace_mixing.mod' due to: qs_gspace_mixing.o /build/reproducible-path/cp2k-8.1/src/qs_gspace_mixing.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod pw_env_types.mod qs_density_mixing_types.mod pw_pool_types.mod cp_control_types.mod pw_types.mod qs_rho_atom_types.mod qs_rho_types.mod mathlib.mod message_passing.mod kinds.mod pw_methods.mod base_hooks.mod qs_scf_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_diagonalization.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_diagonalization.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_rho_types.mod qs_neighbor_list_types.mod qs_mo_types.mod kpoint_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_scf_types.mod qs_density_mixing_types.mod cp_fm_types.mod cp_cfm_types.mod scf_control_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod qs_ot_eigensolver.mod input_constants.mod qs_mixing_utils.mod cp_gemm_interface.mod qs_ks_methods.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod cp_fm_struct.mod qs_matrix_pools.mod cp_cfm_diag.mod qs_rho_methods.mod kinds.mod qs_scf_lanczos.mod kpoint_methods.mod preconditioner.mod cp_output_handling.mod cp_array_utils.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_scf_block_davidson.mod cp_dbcsr_cp2k_link.mod cp_fm_cholesky.mod qs_diis.mod qs_scf_methods.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod qs_mo_methods.mod machine.mod qs_gspace_mixing.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_diagonalization.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_diagonalization.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod scf_control_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_section_types.mod cp_cfm_types.mod qs_density_mixing_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_atom_types.mod cp_log_handling.mod qs_ot_eigensolver.mod kinds.mod qs_mixing_utils.mod cp_gemm_interface.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod qs_rho_methods.mod cp_fm_struct.mod qs_mo_occupation.mod cp_dbcsr_operations.mod cp_cfm_basic_linalg.mod qs_matrix_pools.mod qs_mo_methods.mod cp_fm_cholesky.mod cp_cfm_diag.mod qs_ks_methods.mod qs_scf_lanczos.mod cp_fm_basic_linalg.mod qs_scf_block_davidson.mod preconditioner.mod cp_array_utils.mod qs_diis.mod machine.mod base_hooks.mod cp_fm_diag.mod input_constants.mod qs_gspace_mixing.mod kpoint_methods.mod qs_scf_methods.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_diagonalization.F qs_scf_diagonalization.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:42:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_diagonalization.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_diagonalization.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_diagonalization.mod' due to: qs_scf_diagonalization.o /build/reproducible-path/cp2k-8.1/src/qs_scf_diagonalization.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_rho_types.mod qs_neighbor_list_types.mod qs_mo_types.mod kpoint_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_scf_types.mod qs_density_mixing_types.mod cp_fm_types.mod cp_cfm_types.mod scf_control_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod qs_ot_eigensolver.mod input_constants.mod qs_mixing_utils.mod cp_gemm_interface.mod qs_ks_methods.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod cp_fm_struct.mod qs_matrix_pools.mod cp_cfm_diag.mod qs_rho_methods.mod kinds.mod qs_scf_lanczos.mod kpoint_methods.mod preconditioner.mod cp_output_handling.mod cp_array_utils.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_scf_block_davidson.mod cp_dbcsr_cp2k_link.mod cp_fm_cholesky.mod qs_diis.mod qs_scf_methods.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod qs_mo_methods.mod machine.mod qs_gspace_mixing.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:53:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_diagonalization.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_diagonalization.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_diagonalization.mod' due to: qs_scf_diagonalization.o /build/reproducible-path/cp2k-8.1/src/qs_scf_diagonalization.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod scf_control_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_section_types.mod cp_cfm_types.mod qs_density_mixing_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_atom_types.mod cp_log_handling.mod qs_ot_eigensolver.mod kinds.mod qs_mixing_utils.mod cp_gemm_interface.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod qs_rho_methods.mod cp_fm_struct.mod qs_mo_occupation.mod cp_dbcsr_operations.mod cp_cfm_basic_linalg.mod qs_matrix_pools.mod qs_mo_methods.mod cp_fm_cholesky.mod cp_cfm_diag.mod qs_ks_methods.mod qs_scf_lanczos.mod cp_fm_basic_linalg.mod qs_scf_block_davidson.mod preconditioner.mod cp_array_utils.mod qs_diis.mod machine.mod base_hooks.mod cp_fm_diag.mod input_constants.mod qs_gspace_mixing.mod kpoint_methods.mod qs_scf_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mom_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mom_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod scf_control_types.mod input_section_types.mod input_constants.mod string_utilities.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod util.mod kinds.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod bibliography.mod qs_scf_diagonalization.mod base_hooks.mod qs_mo_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_mom_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_mom_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod input_section_types.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod qs_mo_methods.mod string_utilities.mod cp_fm_basic_linalg.mod util.mod cp_blacs_env.mod base_hooks.mod qs_scf_diagonalization.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_mom_methods.F qs_mom_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:42:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mom_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mom_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mom_methods.mod' due to: qs_mom_methods.o /build/reproducible-path/cp2k-8.1/src/qs_mom_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod scf_control_types.mod input_section_types.mod input_constants.mod string_utilities.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod util.mod kinds.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod bibliography.mod qs_scf_diagonalization.mod base_hooks.mod qs_mo_methods.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:53:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_mom_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_mom_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_mom_methods.mod' due to: qs_mom_methods.o /build/reproducible-path/cp2k-8.1/src/qs_mom_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod input_section_types.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod qs_mo_methods.mod string_utilities.mod cp_fm_basic_linalg.mod util.mod cp_blacs_env.mod base_hooks.mod qs_scf_diagonalization.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kpoint_io.o' due to: /build/reproducible-path/cp2k-8.1/src/kpoint_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_dftb_types.mod particle_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod cp_files.mod qs_mo_io.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod qs_dftb_utils.mod message_passing.mod cp_log_handling.mod base_hooks.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_wf_history_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_wf_history_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_wf_history_types.mod pw_pool_types.mod qs_ks_types.mod scf_control_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod qs_rho_methods.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod qs_matrix_pools.mod qs_mo_methods.mod cp_fm_basic_linalg.mod mathlib.mod pw_methods.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_wf_history_methods.F qs_wf_history_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:53:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_wf_history_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_wf_history_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_wf_history_methods.mod' due to: qs_wf_history_methods.o /build/reproducible-path/cp2k-8.1/src/qs_wf_history_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_wf_history_types.mod pw_pool_types.mod qs_ks_types.mod scf_control_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod qs_rho_methods.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod qs_matrix_pools.mod qs_mo_methods.mod cp_fm_basic_linalg.mod mathlib.mod pw_methods.mod base_hooks.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kpoint_io.o' due to: /build/reproducible-path/cp2k-8.1/src/kpoint_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod particle_types.mod qs_scf_types.mod cp_fm_types.mod qs_dftb_types.mod atomic_kind_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_log_handling.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod message_passing.mod cp_files.mod orbital_pointers.mod base_hooks.mod qs_mo_io.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kpoint_io.F kpoint_io.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:42:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_io.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kpoint_io.mod' due to: kpoint_io.o /build/reproducible-path/cp2k-8.1/src/kpoint_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_dftb_types.mod particle_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod cp_files.mod qs_mo_io.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod qs_dftb_utils.mod message_passing.mod cp_log_handling.mod base_hooks.mod orbital_pointers.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:54:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_io.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kpoint_io.mod' due to: kpoint_io.o /build/reproducible-path/cp2k-8.1/src/kpoint_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod particle_types.mod qs_scf_types.mod cp_fm_types.mod qs_dftb_types.mod atomic_kind_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_log_handling.mod kinds.mod qs_dftb_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod message_passing.mod cp_files.mod orbital_pointers.mod base_hooks.mod qs_mo_io.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_initial_guess.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_initial_guess.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod external_potential_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod xtb_types.mod input_constants.mod cp_fm_struct.mod qs_mom_methods.mod qs_rho_methods.mod util.mod kinds.mod qs_mo_io.mod cp_output_handling.mod cp_dbcsr_operations.mod qs_dftb_utils.mod qs_mo_methods.mod kpoint_io.mod message_passing.mod input_cp2k_hfx.mod qs_wf_history_methods.mod cp_fm_cholesky.mod particle_methods.mod qs_scf_methods.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod atom_kind_orbitals.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_initial_guess.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_initial_guess.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod kpoint_types.mod scf_control_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod xtb_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod external_potential_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_mom_methods.mod qs_dftb_utils.mod cp_output_handling.mod qs_wf_history_methods.mod qs_rho_methods.mod cp_fm_struct.mod qs_mo_occupation.mod cp_dbcsr_operations.mod message_passing.mod qs_mo_methods.mod cp_fm_cholesky.mod kpoint_io.mod util.mod particle_methods.mod input_cp2k_hfx.mod base_hooks.mod qs_mo_io.mod input_constants.mod qs_scf_methods.mod atom_kind_orbitals.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_initial_guess.F qs_initial_guess.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:42:16 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_initial_guess.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_initial_guess.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:54:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_initial_guess.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_initial_guess.F90 /build/reproducible-path/cp2k-8.1/src/qs_initial_guess.F:448:13: 448 | IF (not_read > 1) THEN | ^ Warning: 'not_read' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_initial_guess.mod' due to: qs_initial_guess.o /build/reproducible-path/cp2k-8.1/src/qs_initial_guess.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod external_potential_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod xtb_types.mod input_constants.mod cp_fm_struct.mod qs_mom_methods.mod qs_rho_methods.mod util.mod kinds.mod qs_mo_io.mod cp_output_handling.mod cp_dbcsr_operations.mod qs_dftb_utils.mod qs_mo_methods.mod kpoint_io.mod message_passing.mod input_cp2k_hfx.mod qs_wf_history_methods.mod cp_fm_cholesky.mod particle_methods.mod qs_scf_methods.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod atom_kind_orbitals.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_initial_guess.mod' due to: qs_initial_guess.o /build/reproducible-path/cp2k-8.1/src/qs_initial_guess.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod kpoint_types.mod scf_control_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod xtb_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod external_potential_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_mom_methods.mod qs_dftb_utils.mod cp_output_handling.mod qs_wf_history_methods.mod qs_rho_methods.mod cp_fm_struct.mod qs_mo_occupation.mod cp_dbcsr_operations.mod message_passing.mod qs_mo_methods.mod cp_fm_cholesky.mod kpoint_io.mod util.mod particle_methods.mod input_cp2k_hfx.mod base_hooks.mod qs_mo_io.mod input_constants.mod qs_scf_methods.mod atom_kind_orbitals.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_qs.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_qs.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_neighbor_list_types.mod qs_kind_types.mod dm_ls_scf_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod particle_types.mod pw_pool_types.mod qs_density_mixing_types.mod particle_list_types.mod atomic_kind_types.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod qs_mixing_utils.mod pw_methods.mod qs_ks_methods.mod qs_rho_methods.mod kinds.mod cp_dbcsr_operations.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod qs_initial_guess.mod qs_gspace_mixing.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_qs.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_qs.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod dm_ls_scf_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_subsys_types.mod qs_density_mixing_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_atom_types.mod cp_log_handling.mod kinds.mod qs_mixing_utils.mod cp_dbcsr_cp2k_link.mod qs_rho_methods.mod cp_dbcsr_operations.mod qs_initial_guess.mod cp_realspace_grid_cube.mod qs_collocate_density.mod qs_ks_methods.mod pw_methods.mod base_hooks.mod input_constants.mod qs_gspace_mixing.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_qs.F dm_ls_scf_qs.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:42:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_qs.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_qs.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_qs.mod' due to: dm_ls_scf_qs.o /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_qs.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_neighbor_list_types.mod qs_kind_types.mod dm_ls_scf_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod particle_types.mod pw_pool_types.mod qs_density_mixing_types.mod particle_list_types.mod atomic_kind_types.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod qs_mixing_utils.mod pw_methods.mod qs_ks_methods.mod qs_rho_methods.mod kinds.mod cp_dbcsr_operations.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod qs_initial_guess.mod qs_gspace_mixing.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:54:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_qs.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_qs.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_qs.mod' due to: dm_ls_scf_qs.o /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_qs.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod dm_ls_scf_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_subsys_types.mod qs_density_mixing_types.mod cp_control_types.mod qs_energy_types.mod qs_rho_atom_types.mod cp_log_handling.mod kinds.mod qs_mixing_utils.mod cp_dbcsr_cp2k_link.mod qs_rho_methods.mod cp_dbcsr_operations.mod qs_initial_guess.mod cp_realspace_grid_cube.mod qs_collocate_density.mod qs_ks_methods.mod pw_methods.mod base_hooks.mod input_constants.mod qs_gspace_mixing.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pexsi_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pexsi_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod input_section_types.mod pexsi_types.mod qs_environment_types.mod qs_ks_types.mod qs_energy_types.mod arnoldi_api.mod cp_log_handling.mod message_passing.mod base_hooks.mod pexsi_interface.mod cp_dbcsr_cp2k_link.mod dm_ls_scf_qs.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pexsi_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pexsi_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pexsi_types.mod dm_ls_scf_types.mod qs_ks_types.mod qs_energy_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod dm_ls_scf_qs.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod arnoldi_api.mod pexsi_interface.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pexsi_methods.F pexsi_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:42:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pexsi_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pexsi_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pexsi_methods.mod' due to: pexsi_methods.o /build/reproducible-path/cp2k-8.1/src/pexsi_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod input_section_types.mod pexsi_types.mod qs_environment_types.mod qs_ks_types.mod qs_energy_types.mod arnoldi_api.mod cp_log_handling.mod message_passing.mod base_hooks.mod pexsi_interface.mod cp_dbcsr_cp2k_link.mod dm_ls_scf_qs.mod cp_dbcsr_operations.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:54:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pexsi_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pexsi_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pexsi_methods.mod' due to: pexsi_methods.o /build/reproducible-path/cp2k-8.1/src/pexsi_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pexsi_types.mod dm_ls_scf_types.mod qs_ks_types.mod qs_energy_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod dm_ls_scf_qs.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod arnoldi_api.mod pexsi_interface.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_param_fock.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_param_fock.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod mathlib.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_param_fock.F pao_param_fock.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:54:26 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param_fock.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param_fock.F90 +/build/reproducible-path/cp2k-8.1/src/pao_param_fock.F:155:83: + + 155 | D2(i, i) = D2(i, i) - 2.0_dp*alpha*diff/beta**2*EXP(-(diff/beta)**2) + | ^ +Warning: 'beta' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/pao_param_fock.F:155:83: Warning: 'alpha' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_param_fock.mod' due to: pao_param_fock.o /build/reproducible-path/cp2k-8.1/src/pao_param_fock.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod mathlib.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_potentials.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_potentials.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod particle_types.mod qs_environment_types.mod cell_types.mod ao_util.mod ai_overlap.mod mathlib.mod mathconstants.mod base_hooks.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_potentials.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_potentials.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod qs_kind_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod mathlib.mod ao_util.mod mathconstants.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_overlap.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_potentials.F pao_potentials.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:42:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_potentials.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_potentials.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:54:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_potentials.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_potentials.F90 /build/reproducible-path/cp2k-8.1/src/pao_potentials.F:119:76: 119 | REAL(dp), DIMENSION(:, :, :), POINTER :: dab, new_block_D, saab @@ -43925,108 +44074,41 @@ 119 | REAL(dp), DIMENSION(:, :, :), POINTER :: dab, new_block_D, saab | ^ Warning: 'new_block_d.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_potentials.mod' due to: pao_potentials.o /build/reproducible-path/cp2k-8.1/src/pao_potentials.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod particle_types.mod qs_environment_types.mod cell_types.mod ao_util.mod ai_overlap.mod mathlib.mod mathconstants.mod base_hooks.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_potentials.mod' due to: pao_potentials.o /build/reproducible-path/cp2k-8.1/src/pao_potentials.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod qs_kind_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod mathlib.mod ao_util.mod mathconstants.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_overlap.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_param_exp.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_param_exp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod qs_environment_types.mod pao_types.mod pao_potentials.mod mathlib.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_param_exp.F pao_param_exp.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:42:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param_exp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param_exp.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_param_exp.mod' due to: pao_param_exp.o /build/reproducible-path/cp2k-8.1/src/pao_param_exp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod qs_environment_types.mod pao_types.mod pao_potentials.mod mathlib.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_param_gth.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_param_gth.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod dm_ls_scf_types.mod pao_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod particle_types.mod message_passing.mod kinds.mod iterate_matrix.mod orbital_pointers.mod machine.mod base_hooks.mod pao_param_fock.mod pao_potentials.mod arnoldi_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_param_gth.F pao_param_gth.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:54:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param_gth.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param_gth.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_param_gth.mod' due to: pao_param_gth.o /build/reproducible-path/cp2k-8.1/src/pao_param_gth.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod dm_ls_scf_types.mod pao_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod particle_types.mod message_passing.mod kinds.mod iterate_matrix.mod orbital_pointers.mod machine.mod base_hooks.mod pao_param_fock.mod pao_potentials.mod arnoldi_api.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_linpot_full.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_linpot_full.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod qs_environment_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_linpot_full.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_linpot_full.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod qs_kind_types.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_linpot_full.F pao_linpot_full.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:42:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_linpot_full.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_linpot_full.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_linpot_full.mod' due to: pao_linpot_full.o /build/reproducible-path/cp2k-8.1/src/pao_linpot_full.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod qs_environment_types.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:54:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_linpot_full.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_linpot_full.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_linpot_full.mod' due to: pao_linpot_full.o /build/reproducible-path/cp2k-8.1/src/pao_linpot_full.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod qs_kind_types.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_linpot_rotinv.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_linpot_rotinv.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod particle_types.mod qs_environment_types.mod cell_types.mod ai_overlap.mod mathlib.mod mathconstants.mod base_hooks.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_linpot_rotinv.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_linpot_rotinv.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod qs_kind_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod mathlib.mod mathconstants.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_overlap.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_linpot_rotinv.F pao_linpot_rotinv.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:42:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_linpot_rotinv.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_linpot_rotinv.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_linpot_rotinv.mod' due to: pao_linpot_rotinv.o /build/reproducible-path/cp2k-8.1/src/pao_linpot_rotinv.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod particle_types.mod qs_environment_types.mod cell_types.mod ai_overlap.mod mathlib.mod mathconstants.mod base_hooks.mod orbital_pointers.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_param_fock.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_param_fock.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod mathlib.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_param_fock.F pao_param_fock.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:42:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param_fock.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param_fock.F90 -/build/reproducible-path/cp2k-8.1/src/pao_param_fock.F:155:83: - - 155 | D2(i, i) = D2(i, i) - 2.0_dp*alpha*diff/beta**2*EXP(-(diff/beta)**2) - | ^ -Warning: 'beta' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/pao_param_fock.F:155:83: Warning: 'alpha' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_param_fock.mod' due to: pao_param_fock.o /build/reproducible-path/cp2k-8.1/src/pao_param_fock.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod mathlib.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:54:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_linpot_rotinv.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_linpot_rotinv.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_linpot_rotinv.mod' due to: pao_linpot_rotinv.o /build/reproducible-path/cp2k-8.1/src/pao_linpot_rotinv.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod qs_kind_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod mathlib.mod mathconstants.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_overlap.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_param_linpot.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_param_linpot.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pao_types.mod atomic_kind_types.mod pao_linpot_full.mod pao_potentials.mod pao_input.mod kinds.mod pao_linpot_rotinv.mod pao_param_fock.mod message_passing.mod mathlib.mod base_hooks.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_param_linpot.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_param_linpot.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod pao_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod cp_control_types.mod pao_linpot_full.mod kinds.mod pao_linpot_rotinv.mod pao_input.mod pao_param_fock.mod message_passing.mod mathlib.mod machine.mod base_hooks.mod pao_potentials.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_param_linpot.F pao_param_linpot.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:43:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param_linpot.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param_linpot.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_param_linpot.mod' due to: pao_param_linpot.o /build/reproducible-path/cp2k-8.1/src/pao_param_linpot.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pao_types.mod atomic_kind_types.mod pao_linpot_full.mod pao_potentials.mod pao_input.mod kinds.mod pao_linpot_rotinv.mod pao_param_fock.mod message_passing.mod mathlib.mod base_hooks.mod machine.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:54:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param_linpot.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param_linpot.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_param_linpot.mod' due to: pao_param_linpot.o /build/reproducible-path/cp2k-8.1/src/pao_param_linpot.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod pao_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod cp_control_types.mod pao_linpot_full.mod kinds.mod pao_linpot_rotinv.mod pao_input.mod pao_param_fock.mod message_passing.mod mathlib.mod machine.mod base_hooks.mod pao_potentials.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_param_gth.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_param_gth.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod dm_ls_scf_types.mod qs_kind_types.mod particle_types.mod pao_types.mod qs_environment_types.mod cell_types.mod pao_potentials.mod arnoldi_api.mod message_passing.mod pao_param_fock.mod base_hooks.mod iterate_matrix.mod machine.mod orbital_pointers.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_param_gth.F pao_param_gth.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:43:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param_gth.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param_gth.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_param_gth.mod' due to: pao_param_gth.o /build/reproducible-path/cp2k-8.1/src/pao_param_gth.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod dm_ls_scf_types.mod qs_kind_types.mod particle_types.mod pao_types.mod qs_environment_types.mod cell_types.mod pao_potentials.mod arnoldi_api.mod message_passing.mod pao_param_fock.mod base_hooks.mod iterate_matrix.mod machine.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_param_exp.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_param_exp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod pao_types.mod qs_kind_types.mod mathlib.mod kinds.mod base_hooks.mod pao_potentials.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_param_exp.F pao_param_exp.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:55:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param_exp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param_exp.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_param_exp.mod' due to: pao_param_exp.o /build/reproducible-path/cp2k-8.1/src/pao_param_exp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod pao_types.mod qs_kind_types.mod mathlib.mod kinds.mod base_hooks.mod pao_potentials.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_param.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_param.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod qs_environment_types.mod pao_types.mod pao_param_exp.mod cp_log_handling.mod message_passing.mod base_hooks.mod pao_input.mod pao_param_linpot.mod kinds.mod pao_param_gth.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_param.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_param.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod dm_ls_scf_types.mod pao_types.mod message_passing.mod pao_param_gth.mod cp_log_handling.mod kinds.mod base_hooks.mod pao_input.mod pao_param_linpot.mod pao_param_exp.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_param.F pao_param.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:43:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_param.mod' due to: pao_param.o /build/reproducible-path/cp2k-8.1/src/pao_param.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod qs_environment_types.mod pao_types.mod pao_param_exp.mod cp_log_handling.mod message_passing.mod base_hooks.mod pao_input.mod pao_param_linpot.mod kinds.mod pao_param_gth.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_io.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_kind_types.mod basis_set_types.mod dm_ls_scf_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod pao_types.mod atomic_kind_types.mod input_section_types.mod pao_param.mod pao_input.mod cp_files.mod kinds.mod cp_output_handling.mod physcon.mod message_passing.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_io.F pao_io.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:43:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_io.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_io.mod' due to: pao_io.o /build/reproducible-path/cp2k-8.1/src/pao_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_kind_types.mod basis_set_types.mod dm_ls_scf_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod pao_types.mod atomic_kind_types.mod input_section_types.mod pao_param.mod pao_input.mod cp_files.mod kinds.mod cp_output_handling.mod physcon.mod message_passing.mod cp_log_handling.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_optimizer.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_optimizer.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod arnoldi_api.mod base_hooks.mod pao_input.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_optimizer.F pao_optimizer.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:43:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_optimizer.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_optimizer.F90 -/build/reproducible-path/cp2k-8.1/src/pao_optimizer.F:197:13: - - 197 | IF (beta < 0.0_dp) THEN - | ^ -Warning: 'beta' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_optimizer.mod' due to: pao_optimizer.o /build/reproducible-path/cp2k-8.1/src/pao_optimizer.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod arnoldi_api.mod base_hooks.mod pao_input.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_ml_neuralnet.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_ml_neuralnet.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod parallel_rng_types.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_ml_neuralnet.F pao_ml_neuralnet.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:43:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_ml_neuralnet.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_ml_neuralnet.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_ml_neuralnet.mod' due to: pao_ml_neuralnet.o /build/reproducible-path/cp2k-8.1/src/pao_ml_neuralnet.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod parallel_rng_types.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_ml_gaussprocess.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_ml_gaussprocess.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_ml_gaussprocess.F pao_ml_gaussprocess.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:43:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_ml_gaussprocess.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_ml_gaussprocess.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_ml_gaussprocess.mod' due to: pao_ml_gaussprocess.o /build/reproducible-path/cp2k-8.1/src/pao_ml_gaussprocess.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_ml_descriptor.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod pao_types.mod cell_types.mod particle_types.mod pao_potentials.mod mathlib.mod mathconstants.mod base_hooks.mod pao_input.mod util.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F pao_ml_descriptor.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:43:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_ml_descriptor.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_ml_descriptor.F90 -/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:316:100: - - 316 | block_M(:, :) = block_M(:, :) + w*MATMUL(S_evecs(:, k:k), TRANSPOSE(S_evecs(:, k:k))) - | ^ -Warning: 'block_m.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:214:67: - - 214 | REAL(dp), ALLOCATABLE, DIMENSION(:, :) :: block_M, block_S, S_evecs - | ^ -note: 'block_m.dim[1].ubound' was declared here -/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:214:67: Warning: 'block_m.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:214:67: Warning: 'block_m.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:214:67: Warning: 'block_m.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:111:67: - - 111 | REAL(dp), ALLOCATABLE, DIMENSION(:, :) :: block_M, block_V, V_evecs - | ^ -Warning: 'block_m.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:111:67: Warning: 'block_m.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:111:67: Warning: 'block_m.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:111:67: Warning: 'block_m.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_ml_descriptor.mod' due to: pao_ml_descriptor.o /build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod pao_types.mod cell_types.mod particle_types.mod pao_potentials.mod mathlib.mod mathconstants.mod base_hooks.mod pao_input.mod util.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_ml.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_ml.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod cp_para_types.mod qs_kind_types.mod pao_types.mod qs_environment_types.mod cell_types.mod particle_types.mod pao_io.mod pao_ml_neuralnet.mod message_passing.mod pao_ml_gaussprocess.mod base_hooks.mod pao_ml_descriptor.mod pao_input.mod machine.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_ml.F pao_ml.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:43:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_ml.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_ml.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_ml.mod' due to: pao_ml.o /build/reproducible-path/cp2k-8.1/src/pao_ml.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod cp_para_types.mod qs_kind_types.mod pao_types.mod qs_environment_types.mod cell_types.mod particle_types.mod pao_io.mod pao_ml_neuralnet.mod message_passing.mod pao_ml_gaussprocess.mod base_hooks.mod pao_ml_descriptor.mod pao_input.mod machine.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:55:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_param.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_param.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_param.mod' due to: pao_param.o /build/reproducible-path/cp2k-8.1/src/pao_param.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod dm_ls_scf_types.mod pao_types.mod message_passing.mod pao_param_gth.mod cp_log_handling.mod kinds.mod base_hooks.mod pao_input.mod pao_param_linpot.mod pao_param_exp.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod input_constants.mod arnoldi_api.mod cp_log_handling.mod mathlib.mod base_hooks.mod iterate_matrix.mod dm_ls_scf_qs.mod machine.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod mathlib.mod cp_log_handling.mod kinds.mod iterate_matrix.mod base_hooks.mod machine.mod dm_ls_scf_qs.mod input_constants.mod arnoldi_api.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_methods.F dm_ls_scf_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:43:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:55:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_methods.F90 /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_methods.F:1372:79: 1372 | xr = (xr*xr)*(4*xr - 3*xr*xr) + gamma_values(k)*xr*xr*((1 - xr)**2) @@ -44053,11 +44135,57 @@ | ^ Warning: 'mu_low' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_methods.F:440:19: Warning: 'mu_high' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_methods.mod' due to: dm_ls_scf_methods.o /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod input_constants.mod arnoldi_api.mod cp_log_handling.mod mathlib.mod base_hooks.mod iterate_matrix.mod dm_ls_scf_qs.mod machine.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_methods.mod' due to: dm_ls_scf_methods.o /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod mathlib.mod cp_log_handling.mod kinds.mod iterate_matrix.mod base_hooks.mod machine.mod dm_ls_scf_qs.mod input_constants.mod arnoldi_api.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_ml_descriptor.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod pao_types.mod qs_kind_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod mathlib.mod util.mod mathconstants.mod kinds.mod base_hooks.mod pao_input.mod pao_potentials.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F pao_ml_descriptor.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:55:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_ml_descriptor.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_ml_descriptor.F90 +/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:316:100: + + 316 | block_M(:, :) = block_M(:, :) + w*MATMUL(S_evecs(:, k:k), TRANSPOSE(S_evecs(:, k:k))) + | ^ +Warning: 'block_m.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:214:67: + + 214 | REAL(dp), ALLOCATABLE, DIMENSION(:, :) :: block_M, block_S, S_evecs + | ^ +note: 'block_m.dim[1].ubound' was declared here +/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:214:67: Warning: 'block_m.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:214:67: Warning: 'block_m.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:214:67: Warning: 'block_m.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:111:67: + + 111 | REAL(dp), ALLOCATABLE, DIMENSION(:, :) :: block_M, block_V, V_evecs + | ^ +Warning: 'block_m.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:111:67: Warning: 'block_m.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:111:67: Warning: 'block_m.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F:111:67: Warning: 'block_m.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_ml_descriptor.mod' due to: pao_ml_descriptor.o /build/reproducible-path/cp2k-8.1/src/pao_ml_descriptor.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod pao_types.mod qs_kind_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod mathlib.mod util.mod mathconstants.mod kinds.mod base_hooks.mod pao_input.mod pao_potentials.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_ml_neuralnet.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_ml_neuralnet.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod pao_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_ml_neuralnet.F pao_ml_neuralnet.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:55:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_ml_neuralnet.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_ml_neuralnet.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_ml_neuralnet.mod' due to: pao_ml_neuralnet.o /build/reproducible-path/cp2k-8.1/src/pao_ml_neuralnet.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod pao_types.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_io.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod particle_types.mod dm_ls_scf_types.mod pao_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod pao_input.mod pao_param.mod message_passing.mod cp_files.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_io.F pao_io.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:55:29 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_io.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_io.mod' due to: pao_io.o /build/reproducible-path/cp2k-8.1/src/pao_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod particle_types.mod dm_ls_scf_types.mod pao_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod pao_input.mod pao_param.mod message_passing.mod cp_files.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_ml_gaussprocess.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_ml_gaussprocess.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_ml_gaussprocess.F pao_ml_gaussprocess.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:55:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_ml_gaussprocess.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_ml_gaussprocess.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_ml_gaussprocess.mod' due to: pao_ml_gaussprocess.o /build/reproducible-path/cp2k-8.1/src/pao_ml_gaussprocess.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_ml.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_ml.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod basis_set_types.mod qs_environment_types.mod pao_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod particle_types.mod message_passing.mod pao_ml_descriptor.mod pao_ml_neuralnet.mod kinds.mod base_hooks.mod pao_io.mod pao_input.mod pao_ml_gaussprocess.mod machine.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_ml.F pao_ml.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:55:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_ml.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_ml.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_ml.mod' due to: pao_ml.o /build/reproducible-path/cp2k-8.1/src/pao_ml.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod basis_set_types.mod qs_environment_types.mod pao_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod particle_types.mod message_passing.mod pao_ml_descriptor.mod pao_ml_neuralnet.mod kinds.mod base_hooks.mod pao_io.mod pao_input.mod pao_ml_gaussprocess.mod machine.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_kind_types.mod basis_set_types.mod dm_ls_scf_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pao_types.mod atomic_kind_types.mod qs_ks_types.mod qs_energy_types.mod qs_ks_methods.mod pao_param.mod dm_ls_scf_qs.mod pao_ml.mod qs_rho_methods.mod kinds.mod dm_ls_scf_methods.mod ao_util.mod message_passing.mod iterate_matrix.mod bibliography.mod mathlib.mod cp_log_handling.mod base_hooks.mod qs_initial_guess.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod dm_ls_scf_types.mod pao_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod pao_param.mod qs_rho_methods.mod bibliography.mod message_passing.mod qs_initial_guess.mod dm_ls_scf_qs.mod dm_ls_scf_methods.mod qs_ks_methods.mod mathlib.mod iterate_matrix.mod pao_ml.mod machine.mod base_hooks.mod ao_util.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_methods.F pao_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:43:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:55:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_methods.F90 /build/reproducible-path/cp2k-8.1/src/pao_methods.F:1023:32: 1023 | block_X(i, j) = old_Xij @@ -44068,67 +44196,319 @@ 975 | delta = ABS(Gij_num - block_G(i, j)) | ^ Warning: 'gij_num' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_methods.mod' due to: pao_methods.o /build/reproducible-path/cp2k-8.1/src/pao_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_kind_types.mod basis_set_types.mod dm_ls_scf_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pao_types.mod atomic_kind_types.mod qs_ks_types.mod qs_energy_types.mod qs_ks_methods.mod pao_param.mod dm_ls_scf_qs.mod pao_ml.mod qs_rho_methods.mod kinds.mod dm_ls_scf_methods.mod ao_util.mod message_passing.mod iterate_matrix.mod bibliography.mod mathlib.mod cp_log_handling.mod base_hooks.mod qs_initial_guess.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_methods.mod' due to: pao_methods.o /build/reproducible-path/cp2k-8.1/src/pao_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod dm_ls_scf_types.mod pao_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod pao_param.mod qs_rho_methods.mod bibliography.mod message_passing.mod qs_initial_guess.mod dm_ls_scf_qs.mod dm_ls_scf_methods.mod qs_ks_methods.mod mathlib.mod iterate_matrix.mod pao_ml.mod machine.mod base_hooks.mod ao_util.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_optimizer.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_optimizer.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod kinds.mod base_hooks.mod pao_input.mod arnoldi_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_optimizer.F pao_optimizer.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:55:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_optimizer.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_optimizer.F90 +/build/reproducible-path/cp2k-8.1/src/pao_optimizer.F:197:13: + + 197 | IF (beta < 0.0_dp) THEN + | ^ +Warning: 'beta' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_optimizer.mod' due to: pao_optimizer.o /build/reproducible-path/cp2k-8.1/src/pao_optimizer.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pao_types.mod kinds.mod base_hooks.mod pao_input.mod arnoldi_api.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_main.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_main.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod input_section_types.mod pao_types.mod qs_environment_types.mod pao_io.mod pao_optimizer.mod base_hooks.mod cp_external_control.mod pao_param.mod pao_input.mod bibliography.mod pao_ml.mod machine.mod linesearch.mod kinds.mod pao_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pao_main.o' due to: /build/reproducible-path/cp2k-8.1/src/pao_main.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod dm_ls_scf_types.mod pao_types.mod input_section_types.mod cp_external_control.mod kinds.mod linesearch.mod pao_methods.mod base_hooks.mod pao_io.mod pao_input.mod pao_ml.mod pao_optimizer.mod pao_param.mod machine.mod bibliography.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pao_main.F pao_main.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:43:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_main.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_main.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_main.mod' due to: pao_main.o /build/reproducible-path/cp2k-8.1/src/pao_main.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod input_section_types.mod pao_types.mod qs_environment_types.mod pao_io.mod pao_optimizer.mod base_hooks.mod cp_external_control.mod pao_param.mod pao_input.mod bibliography.mod pao_ml.mod machine.mod linesearch.mod kinds.mod pao_methods.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:55:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pao_main.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pao_main.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pao_main.mod' due to: pao_main.o /build/reproducible-path/cp2k-8.1/src/pao_main.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod dm_ls_scf_types.mod pao_types.mod input_section_types.mod cp_external_control.mod kinds.mod linesearch.mod pao_methods.mod base_hooks.mod pao_io.mod pao_input.mod pao_ml.mod pao_optimizer.mod pao_param.mod machine.mod bibliography.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_create.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_create.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod pexsi_types.mod input_enumeration_types.mod dm_ls_scf_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_density_mixing_types.mod input_section_types.mod molecule_types.mod input_constants.mod pexsi_methods.mod kinds.mod pao_main.mod bibliography.mod cp_para_env.mod cp_log_handling.mod base_hooks.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_create.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_create.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod input_enumeration_types.mod molecule_types.mod dm_ls_scf_types.mod input_keyword_types.mod qs_environment_types.mod input_section_types.mod pexsi_types.mod qs_density_mixing_types.mod cp_control_types.mod pexsi_methods.mod cp_log_handling.mod kinds.mod bibliography.mod cp_para_env.mod machine.mod base_hooks.mod input_constants.mod pao_main.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_create.F dm_ls_scf_create.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:44:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_create.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_create.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_create.mod' due to: dm_ls_scf_create.o /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_create.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod pexsi_types.mod input_enumeration_types.mod dm_ls_scf_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_density_mixing_types.mod input_section_types.mod molecule_types.mod input_constants.mod pexsi_methods.mod kinds.mod pao_main.mod bibliography.mod cp_para_env.mod cp_log_handling.mod base_hooks.mod machine.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:55:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_create.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_create.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_create.mod' due to: dm_ls_scf_create.o /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_create.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod input_enumeration_types.mod molecule_types.mod dm_ls_scf_types.mod input_keyword_types.mod qs_environment_types.mod input_section_types.mod pexsi_types.mod qs_density_mixing_types.mod cp_control_types.mod pexsi_methods.mod cp_log_handling.mod kinds.mod bibliography.mod cp_para_env.mod machine.mod base_hooks.mod input_constants.mod pao_main.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_spin_orbit.mod' due to: ai_spin_orbit.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dispersion_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dispersion_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_kind_types.mod qs_dispersion_types.mod input_section_types.mod atomic_kind_types.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod physcon.mod cp_output_handling.mod qs_dispersion_pairpot.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dispersion_utils.F qs_dispersion_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:56:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dispersion_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dispersion_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dispersion_utils.mod' due to: qs_dispersion_utils.o /build/reproducible-path/cp2k-8.1/src/qs_dispersion_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_kind_types.mod qs_dispersion_types.mod input_section_types.mod atomic_kind_types.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod physcon.mod cp_output_handling.mod qs_dispersion_pairpot.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_spin_orbit.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_spin_orbit.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod input_section_types.mod particle_types.mod qs_kind_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cell_types.mod block_p_types.mod cp_log_handling.mod base_hooks.mod cp_dbcsr_output.mod cp_output_handling.mod orbital_pointers.mod ai_spin_orbit.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_spin_orbit.F qs_spin_orbit.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:44:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_spin_orbit.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_spin_orbit.F90 -/build/reproducible-path/cp2k-8.1/src/qs_spin_orbit.F:195:13: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ec_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/ec_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_dispersion_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod basis_set_container_types.mod ec_env_types.mod kinds.mod qs_interactions.mod qs_dispersion_utils.mod string_utilities.mod qs_dispersion_nonloc.mod orbital_pointers.mod qs_dispersion_pairpot.mod base_hooks.mod input_cp2k_check.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ec_environment.F ec_environment.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:56:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ec_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ec_environment.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ec_environment.mod' due to: ec_environment.o /build/reproducible-path/cp2k-8.1/src/ec_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_dispersion_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod basis_set_container_types.mod ec_env_types.mod kinds.mod qs_interactions.mod qs_dispersion_utils.mod string_utilities.mod qs_dispersion_nonloc.mod orbital_pointers.mod qs_dispersion_pairpot.mod base_hooks.mod input_cp2k_check.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_expns3_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_expns3_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_expns3_types.mod semi_empirical_types.mod cp_control_types.mod qs_kind_types.mod semi_empirical_int3_utils.mod kinds.mod input_constants.mod semi_empirical_int_arrays.mod semi_empirical_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_expns3_methods.F semi_empirical_expns3_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:56:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_expns3_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_expns3_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'semi_empirical_expns3_methods.mod' due to: semi_empirical_expns3_methods.o /build/reproducible-path/cp2k-8.1/src/semi_empirical_expns3_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_expns3_types.mod semi_empirical_types.mod cp_control_types.mod qs_kind_types.mod semi_empirical_int3_utils.mod kinds.mod input_constants.mod semi_empirical_int_arrays.mod semi_empirical_utils.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_gcp_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_gcp_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod cp_parser_types.mod qs_gcp_types.mod input_section_types.mod mathconstants.mod kinds.mod sto_ng.mod periodic_table.mod cp_parser_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_gcp_utils.F qs_gcp_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:56:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gcp_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gcp_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_gcp_utils.mod' due to: qs_gcp_utils.o /build/reproducible-path/cp2k-8.1/src/qs_gcp_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod cp_parser_types.mod qs_gcp_types.mod input_section_types.mod mathconstants.mod kinds.mod sto_ng.mod periodic_table.mod cp_parser_methods.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewald_pw_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/ewald_pw_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod ewald_pw_types.mod dg_rho0_types.mod pw_grid_types.mod pw_pool_types.mod ewald_environment_types.mod dg_types.mod input_section_types.mod kinds.mod pw_grids.mod base_hooks.mod pw_poisson_methods.mod pw_poisson_read_input.mod dgs.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewald_pw_methods.F ewald_pw_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:56:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewald_pw_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewald_pw_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewald_pw_methods.mod' due to: ewald_pw_methods.o /build/reproducible-path/cp2k-8.1/src/ewald_pw_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod ewald_pw_types.mod dg_rho0_types.mod pw_grid_types.mod pw_pool_types.mod ewald_environment_types.mod dg_types.mod input_section_types.mod kinds.mod pw_grids.mod base_hooks.mod pw_poisson_methods.mod pw_poisson_read_input.mod dgs.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_write_output.o' due to: /build/reproducible-path/cp2k-8.1/src/xc_write_output.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_cp2k_check.mod kinds.mod input_constants.mod xc_derivatives.mod xc_libxc.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc_write_output.F xc_write_output.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:56:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc_write_output.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_write_output.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_write_output.mod' due to: xc_write_output.o /build/reproducible-path/cp2k-8.1/src/xc_write_output.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_cp2k_check.mod kinds.mod input_constants.mod xc_derivatives.mod xc_libxc.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_control_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/cp_control_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_enumeration_types.mod xc_rho_cflags_types.mod input_keyword_types.mod input_section_types.mod pair_potential_types.mod cp_control_types.mod cp_log_handling.mod qs_cdft_utils.mod kinds.mod cp_output_handling.mod force_fields_input.mod periodic_table.mod bibliography.mod xc_write_output.mod xc_input_constants.mod string_utilities.mod input_cp2k_dft.mod util.mod cp_files.mod xc_derivatives.mod base_hooks.mod mathconstants.mod input_cp2k_check.mod input_constants.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp_control_utils.F cp_control_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:56:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp_control_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_control_utils.F90 +/build/reproducible-path/cp2k-8.1/src/cp_control_utils.F:1677:51: - 195 | IF (jatom /= last_jatom) THEN - | ^ -Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_spin_orbit.mod' due to: qs_spin_orbit.o /build/reproducible-path/cp2k-8.1/src/qs_spin_orbit.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod input_section_types.mod particle_types.mod qs_kind_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cell_types.mod block_p_types.mod cp_log_handling.mod base_hooks.mod cp_dbcsr_output.mod cp_output_handling.mod orbital_pointers.mod ai_spin_orbit.mod kinds.mod + 1677 | method = enum_i2c(enum, qs_control%method_id) + | 1 +Warning: CHARACTER expression will be truncated in assignment (20/80) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/src/cp_control_utils.F:1682:69: + + 1682 | quadrature = enum_i2c(enum, qs_control%gapw_control%quadrature) + | 1 +Warning: CHARACTER expression will be truncated in assignment (20/80) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/src/cp_control_utils.F:208:53: + + 208 | dft_control%auto_basis_aux_fit = isize + | ^ +Warning: 'isize' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_control_utils.mod' due to: cp_control_utils.o /build/reproducible-path/cp2k-8.1/src/cp_control_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_enumeration_types.mod xc_rho_cflags_types.mod input_keyword_types.mod input_section_types.mod pair_potential_types.mod cp_control_types.mod cp_log_handling.mod qs_cdft_utils.mod kinds.mod cp_output_handling.mod force_fields_input.mod periodic_table.mod bibliography.mod xc_write_output.mod xc_input_constants.mod string_utilities.mod input_cp2k_dft.mod util.mod cp_files.mod xc_derivatives.mod base_hooks.mod mathconstants.mod input_cp2k_check.mod input_constants.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_setup.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_setup.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod input_section_types.mod mathlib.mod cp_eri_mme_interface.mod cp_log_handling.mod kinds.mod input_constants.mod cp_output_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_setup.F mp2_setup.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:56:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_setup.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_setup.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_setup.mod' due to: mp2_setup.o /build/reproducible-path/cp2k-8.1/src/mp2_setup.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod input_section_types.mod mathlib.mod cp_eri_mme_interface.mod cp_log_handling.mod kinds.mod input_constants.mod cp_output_handling.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_update_s_mstruct.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_update_s_mstruct.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_scf_types.mod qs_neighbor_list_types.mod qs_ks_types.mod cp_control_types.mod pw_types.mod qs_rho_types.mod task_list_types.mod cp_ddapc_types.mod cp_ddapc_util.mod pw_methods.mod input_constants.mod task_list_methods.mod qs_collocate_density.mod qs_rho_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_update_s_mstruct.F qs_update_s_mstruct.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:56:32 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_update_s_mstruct.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_update_s_mstruct.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_update_s_mstruct.mod' due to: qs_update_s_mstruct.o /build/reproducible-path/cp2k-8.1/src/qs_update_s_mstruct.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_scf_types.mod qs_neighbor_list_types.mod qs_ks_types.mod cp_control_types.mod pw_types.mod qs_rho_types.mod task_list_types.mod cp_ddapc_types.mod cp_ddapc_util.mod pw_methods.mod input_constants.mod task_list_methods.mod qs_collocate_density.mod qs_rho_methods.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_kinetic.mod' due to: ai_kinetic.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_kinetic.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_kinetic.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod qs_ks_types.mod qs_force_types.mod atomic_kind_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod kinds.mod virial_methods.mod cp_dbcsr_operations.mod qs_integral_utils.mod ai_contraction.mod orbital_pointers.mod base_hooks.mod ai_kinetic.mod qs_overlap.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_kinetic.F qs_kinetic.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:56:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_kinetic.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_kinetic.F90 +/build/reproducible-path/cp2k-8.1/src/qs_kinetic.F:165:95: + + 165 | trans, use_cell_mapping, use_virial + | ^ +Warning: 'use_virial' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_kinetic.F:264:46: + + 264 | !$OMP REDUCTION (+ : pv_thread, force_thread ) + | ^ +Warning: 'use_cell_mapping' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_kinetic.F:164:89: + + 164 | LOGICAL :: do_forces, do_symmetric, dokp, found, & + | ^ +Warning: 'dokp' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_kinetic.mod' due to: qs_kinetic.o /build/reproducible-path/cp2k-8.1/src/qs_kinetic.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod qs_ks_types.mod qs_force_types.mod atomic_kind_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod kinds.mod virial_methods.mod cp_dbcsr_operations.mod qs_integral_utils.mod ai_contraction.mod orbital_pointers.mod base_hooks.mod ai_kinetic.mod qs_overlap.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'core_ppnl.o' due to: /build/reproducible-path/cp2k-8.1/src/core_ppnl.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod sap_kind_types.mod external_potential_types.mod qs_kind_types.mod atomic_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_overlap.mod virial_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/core_ppnl.F core_ppnl.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:56:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"core_ppnl.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' core_ppnl.F90 +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:106:89: + + 106 | ldsab, lppnl, maxco, maxder, maxl, maxlgto, maxlppnl, maxppnl, maxsgf, na, natom, nb, & + | ^ +Warning: 'natom' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:76: + + 131 | REAL(KIND=dp), DIMENSION(:), POINTER :: a_nl, alpha_ppnl, hprj, set_radius_a + | ^ +Warning: 'alpha_ppnl.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:76: Warning: 'alpha_ppnl.span' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:76: Warning: 'alpha_ppnl.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:76: Warning: 'alpha_ppnl.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:110:92: + + 110 | INTEGER, DIMENSION(:), POINTER :: la_max, la_min, npgfa, nprj_ppnl, & + | ^ +Warning: 'nprj_ppnl.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:110:92: Warning: 'nprj_ppnl.span' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:110:92: Warning: 'nprj_ppnl.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:110:92: Warning: 'nprj_ppnl.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:130:77: + + 130 | sphi_a, vprj_ppnl, zeta + | ^ +Warning: 'vprj_ppnl.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:130:77: Warning: 'vprj_ppnl.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:130:77: Warning: 'vprj_ppnl.span' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:130:77: Warning: 'vprj_ppnl.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:130:77: Warning: 'vprj_ppnl.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:82: + + 131 | REAL(KIND=dp), DIMENSION(:), POINTER :: a_nl, alpha_ppnl, hprj, set_radius_a + | ^ +Warning: 'hprj.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:82: Warning: 'hprj.span' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:82: Warning: 'hprj.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:131:82: Warning: 'hprj.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:401:111: + + 401 | work(1:np, 1:nb) = MATMUL(sab(1:np, first_col:first_col + nprjc - 1), cprj(1:nprjc, 1:nb)) + | ^ +Warning: 'nprjc' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/core_ppnl.F:107:67: + + 107 | ncoa, ncoc, nkind, nlist, nneighbor, nnl, np, nppnl, nprjc, nseta, nsgfa, prjc, sgfa, slot + | ^ +note: 'nprjc' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'core_ppnl.mod' due to: core_ppnl.o /build/reproducible-path/cp2k-8.1/src/core_ppnl.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod sap_kind_types.mod external_potential_types.mod qs_kind_types.mod atomic_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_overlap.mod virial_methods.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_verfc.mod' due to: ai_verfc.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'core_ae.o' due to: /build/reproducible-path/cp2k-8.1/src/core_ae.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod external_potential_types.mod qs_kind_types.mod atomic_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod ai_verfc.mod kinds.mod orbital_pointers.mod base_hooks.mod virial_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/core_ae.F core_ae.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:56:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"core_ae.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' core_ae.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'core_ae.mod' due to: core_ae.o /build/reproducible-path/cp2k-8.1/src/core_ae.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod external_potential_types.mod qs_kind_types.mod atomic_kind_types.mod particle_types.mod qs_force_types.mod virial_types.mod ai_verfc.mod kinds.mod orbital_pointers.mod base_hooks.mod virial_methods.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kg_tnadd_mat.o' due to: /build/reproducible-path/cp2k-8.1/src/kg_tnadd_mat.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod external_potential_types.mod qs_kind_types.mod atomic_kind_types.mod particle_types.mod kg_environment_types.mod qs_force_types.mod virial_types.mod kinds.mod orbital_pointers.mod base_hooks.mod particle_methods.mod cp_dbcsr_cp2k_link.mod ai_overlap_ppl.mod virial_methods.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kg_tnadd_mat.F kg_tnadd_mat.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:56:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_tnadd_mat.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_tnadd_mat.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kg_tnadd_mat.mod' due to: kg_tnadd_mat.o /build/reproducible-path/cp2k-8.1/src/kg_tnadd_mat.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod external_potential_types.mod qs_kind_types.mod atomic_kind_types.mod particle_types.mod kg_environment_types.mod qs_force_types.mod virial_types.mod kinds.mod orbital_pointers.mod base_hooks.mod particle_methods.mod cp_dbcsr_cp2k_link.mod ai_overlap_ppl.mod virial_methods.mod cp_dbcsr_operations.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_core_hamiltonian.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_core_hamiltonian.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_oce_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_control_types.mod kg_environment_types.mod lri_environment_types.mod cp_log_handling.mod qs_kinetic.mod kinds.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod core_ppnl.mod cp_dbcsr_output.mod qs_condnum.mod core_ae.mod kg_tnadd_mat.mod cp_blacs_env.mod qs_oce_methods.mod base_hooks.mod core_ppl.mod qs_overlap.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_core_hamiltonian.F qs_core_hamiltonian.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_core_hamiltonian.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_core_hamiltonian.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_core_hamiltonian.mod' due to: qs_core_hamiltonian.o /build/reproducible-path/cp2k-8.1/src/qs_core_hamiltonian.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_oce_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_control_types.mod kg_environment_types.mod lri_environment_types.mod cp_log_handling.mod qs_kinetic.mod kinds.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod core_ppnl.mod cp_dbcsr_output.mod qs_condnum.mod core_ae.mod kg_tnadd_mat.mod cp_blacs_env.mod qs_oce_methods.mod base_hooks.mod core_ppl.mod qs_overlap.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_energy_matrix_w.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_energy_matrix_w.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_neighbor_list_types.mod qs_mo_types.mod kpoint_types.mod cp_control_types.mod scf_control_types.mod qs_rho_types.mod cp_fm_types.mod kinds.mod base_hooks.mod kpoint_methods.mod qs_ks_methods.mod cp_fm_struct.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_energy_matrix_w.F qs_energy_matrix_w.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_matrix_w.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_matrix_w.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_energy_matrix_w.mod' due to: qs_energy_matrix_w.o /build/reproducible-path/cp2k-8.1/src/qs_energy_matrix_w.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_neighbor_list_types.mod qs_mo_types.mod kpoint_types.mod cp_control_types.mod scf_control_types.mod qs_rho_types.mod cp_fm_types.mod kinds.mod base_hooks.mod kpoint_methods.mod qs_ks_methods.mod cp_fm_struct.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_basis_gradient.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_basis_gradient.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_mixing_utils.mod qs_rho_methods.mod cp_dbcsr_operations.mod qs_mo_methods.mod qs_neighbor_lists.mod qs_update_s_mstruct.mod qs_ks_methods.mod qs_core_hamiltonian.mod base_hooks.mod qs_energy_matrix_w.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_basis_gradient.F qs_basis_gradient.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_basis_gradient.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_basis_gradient.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_basis_gradient.mod' due to: qs_basis_gradient.o /build/reproducible-path/cp2k-8.1/src/qs_basis_gradient.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_mixing_utils.mod qs_rho_methods.mod cp_dbcsr_operations.mod qs_mo_methods.mod qs_neighbor_lists.mod qs_update_s_mstruct.mod qs_ks_methods.mod qs_core_hamiltonian.mod base_hooks.mod qs_energy_matrix_w.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_outer_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_scf_types.mod cp_control_types.mod scf_control_types.mod qs_cdft_opt_types.mod qs_energy_types.mod qs_cdft_types.mod mathlib.mod qs_basis_gradient.mod cp_log_handling.mod kinds.mod input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F qs_outer_scf.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_outer_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_outer_scf.F90 +/build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F:511:60: + + 511 | ddapc_restraint_control%strength = extrapolation(1) + | ^ +Warning: 'ddapc_restraint_control' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F:415:88: + + 415 | ddapc_restraint_control%strength = scf_env%outer_scf%variables(1, ihistory + 1) + | ^ +Warning: 'ddapc_restraint_control' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F:141:17: + + 141 | CPASSERT(is_constraint) + | ^ +Warning: 'is_constraint' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F:145:81: + + 145 | ddapc_restraint_control%target + | ^ +Warning: 'ddapc_restraint_control' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_outer_scf.mod' due to: qs_outer_scf.o /build/reproducible-path/cp2k-8.1/src/qs_outer_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_scf_types.mod cp_control_types.mod scf_control_types.mod qs_cdft_opt_types.mod qs_energy_types.mod qs_cdft_types.mod mathlib.mod qs_basis_gradient.mod cp_log_handling.mod kinds.mod input_constants.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_environment_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_environment_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_charges_types.mod molecule_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod pw_env_types.mod qs_rho0_types.mod ewald_environment_types.mod pw_types.mod qs_kind_types.mod molecule_kind_types.mod ewald_pw_types.mod cp_control_types.mod kinds.mod qs_rho0_ggrid.mod pw_env_methods.mod cp_dbcsr_operations.mod qs_matrix_pools.mod ewald_pw_methods.mod cp_blacs_env.mod distribution_methods.mod base_hooks.mod input_constants.mod qs_outer_scf.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_environment_methods.F qs_environment_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:24 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_environment_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_environment_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_environment_methods.mod' due to: qs_environment_methods.o /build/reproducible-path/cp2k-8.1/src/qs_environment_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_charges_types.mod molecule_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod pw_env_types.mod qs_rho0_types.mod ewald_environment_types.mod pw_types.mod qs_kind_types.mod molecule_kind_types.mod ewald_pw_types.mod cp_control_types.mod kinds.mod qs_rho0_ggrid.mod pw_env_methods.mod cp_dbcsr_operations.mod qs_matrix_pools.mod ewald_pw_methods.mod cp_blacs_env.mod distribution_methods.mod base_hooks.mod input_constants.mod qs_outer_scf.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'generic_shg_integrals_init.o' due to: /build/reproducible-path/cp2k-8.1/src/shg_int/generic_shg_integrals_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod mathconstants.mod kinds.mod orbital_pointers.mod spherical_harmonics.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/shg_int/generic_shg_integrals_init.F generic_shg_integrals_init.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_int/generic_shg_integrals_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/shg_int/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' generic_shg_integrals_init.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'generic_shg_integrals_init.mod' due to: generic_shg_integrals_init.o /build/reproducible-path/cp2k-8.1/src/shg_int/generic_shg_integrals_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod mathconstants.mod kinds.mod orbital_pointers.mod spherical_harmonics.mod memory_utilities.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_environment_init.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_environment_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod lri_environment_types.mod cp_control_types.mod qs_kind_types.mod input_section_types.mod atomic_kind_types.mod mathlib.mod ao_util.mod mathconstants.mod kinds.mod generic_shg_integrals_init.mod base_hooks.mod generic_shg_integrals.mod bibliography.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_environment_init.F lri_environment_init.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_environment_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_environment_init.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_environment_init.mod' due to: lri_environment_init.o /build/reproducible-path/cp2k-8.1/src/lri_environment_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod lri_environment_types.mod cp_control_types.mod qs_kind_types.mod input_section_types.mod atomic_kind_types.mod mathlib.mod ao_util.mod mathconstants.mod kinds.mod generic_shg_integrals_init.mod base_hooks.mod generic_shg_integrals.mod bibliography.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb_parameters.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb_parameters.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod qs_dftb_types.mod atomic_kind_types.mod external_potential_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod qs_dftb_utils.mod message_passing.mod qmmm_ff_fist.mod string_utilities.mod cp_files.mod base_hooks.mod mathconstants.mod input_constants.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dftb_parameters.F qs_dftb_parameters.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_parameters.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_parameters.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb_parameters.mod' due to: qs_dftb_parameters.o /build/reproducible-path/cp2k-8.1/src/qs_dftb_parameters.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod qs_dftb_types.mod atomic_kind_types.mod external_potential_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod qs_dftb_utils.mod message_passing.mod qmmm_ff_fist.mod string_utilities.mod cp_files.mod base_hooks.mod mathconstants.mod input_constants.mod cp_parser_methods.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kg_vertex_coloring_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kg_environment_types.mod cp_min_heap.mod cp_log_handling.mod kinds.mod input_constants.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F kg_vertex_coloring_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_vertex_coloring_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_vertex_coloring_methods.F90 +/build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F:201:54: + + 201 | IF (newcolor .GT. ncolors) ncolors = newcolor + | ^ +Warning: 'newcolor' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F:174:89: + + 174 | INTEGER :: color, handle, i, j, newcolor, & + | ^ +note: 'newcolor' was declared here +/build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F:120:36: + + 120 | nneighbors = nneighbors + 1 + | ^ +Warning: 'nneighbors' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F:77:81: + + 77 | maxdegree, nneighbors, nnodes + | ^ +note: 'nneighbors' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kg_vertex_coloring_methods.mod' due to: kg_vertex_coloring_methods.o /build/reproducible-path/cp2k-8.1/src/kg_vertex_coloring_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kg_environment_types.mod cp_min_heap.mod cp_log_handling.mod kinds.mod input_constants.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kg_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/kg_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod external_potential_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod integration_grid_types.mod kg_environment_types.mod task_list_types.mod cp_log_handling.mod kinds.mod kg_vertex_coloring_methods.mod bibliography.mod message_passing.mod qs_neighbor_lists.mod string_utilities.mod qs_grid_atom.mod util.mod cp_files.mod base_hooks.mod lri_environment_init.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kg_environment.F kg_environment.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kg_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kg_environment.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kg_environment.mod' due to: kg_environment.o /build/reproducible-path/cp2k-8.1/src/kg_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod external_potential_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod integration_grid_types.mod kg_environment_types.mod task_list_types.mod cp_log_handling.mod kinds.mod kg_vertex_coloring_methods.mod bibliography.mod message_passing.mod qs_neighbor_lists.mod string_utilities.mod qs_grid_atom.mod util.mod cp_files.mod base_hooks.mod lri_environment_init.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_env_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_env_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod input_section_types.mod almo_scf_types.mod kinds.mod input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/almo_scf_env_methods.F almo_scf_env_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_env_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_env_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_env_methods.mod' due to: almo_scf_env_methods.o /build/reproducible-path/cp2k-8.1/src/almo_scf_env_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod input_section_types.mod almo_scf_types.mod kinds.mod input_constants.mod base_hooks.mod true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_fermi_contact.mod' due to: ai_fermi_contact.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fermi_contact.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fermi_contact.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod input_section_types.mod particle_types.mod qs_kind_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cell_types.mod block_p_types.mod cp_log_handling.mod base_hooks.mod cp_dbcsr_output.mod cp_output_handling.mod orbital_pointers.mod ai_fermi_contact.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fermi_contact.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fermi_contact.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod basis_set_types.mod input_section_types.mod qs_neighbor_list_types.mod qs_kind_types.mod particle_types.mod cell_types.mod block_p_types.mod cp_log_handling.mod kinds.mod orbital_pointers.mod base_hooks.mod cp_dbcsr_output.mod cp_output_handling.mod ai_fermi_contact.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fermi_contact.F qs_fermi_contact.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:44:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fermi_contact.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fermi_contact.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fermi_contact.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fermi_contact.F90 /build/reproducible-path/cp2k-8.1/src/qs_fermi_contact.F:195:13: 195 | IF (jatom /= last_jatom) THEN | ^ Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fermi_contact.mod' due to: qs_fermi_contact.o /build/reproducible-path/cp2k-8.1/src/qs_fermi_contact.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod input_section_types.mod particle_types.mod qs_kind_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cell_types.mod block_p_types.mod cp_log_handling.mod base_hooks.mod cp_dbcsr_output.mod cp_output_handling.mod orbital_pointers.mod ai_fermi_contact.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fermi_contact.mod' due to: qs_fermi_contact.o /build/reproducible-path/cp2k-8.1/src/qs_fermi_contact.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod basis_set_types.mod input_section_types.mod qs_neighbor_list_types.mod qs_kind_types.mod particle_types.mod cell_types.mod block_p_types.mod cp_log_handling.mod kinds.mod orbital_pointers.mod base_hooks.mod cp_dbcsr_output.mod cp_output_handling.mod ai_fermi_contact.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_spin_orbit.mod' due to: ai_spin_orbit.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_spin_orbit.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_spin_orbit.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod particle_types.mod cell_types.mod block_p_types.mod input_section_types.mod cp_log_handling.mod kinds.mod orbital_pointers.mod base_hooks.mod cp_dbcsr_output.mod cp_output_handling.mod ai_spin_orbit.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_spin_orbit.F qs_spin_orbit.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:56 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_spin_orbit.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_spin_orbit.F90 +/build/reproducible-path/cp2k-8.1/src/qs_spin_orbit.F:195:13: + + 195 | IF (jatom /= last_jatom) THEN + | ^ +Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_spin_orbit.mod' due to: qs_spin_orbit.o /build/reproducible-path/cp2k-8.1/src/qs_spin_orbit.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod particle_types.mod cell_types.mod block_p_types.mod input_section_types.mod cp_log_handling.mod kinds.mod orbital_pointers.mod base_hooks.mod cp_dbcsr_output.mod cp_output_handling.mod ai_spin_orbit.mod true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_elec_field.mod' due to: ai_elec_field.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_elec_field.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_elec_field.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod input_section_types.mod particle_types.mod qs_kind_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cell_types.mod block_p_types.mod cp_log_handling.mod base_hooks.mod cp_dbcsr_output.mod cp_output_handling.mod orbital_pointers.mod kinds.mod ai_elec_field.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_elec_field.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_elec_field.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cell_types.mod particle_types.mod block_p_types.mod input_section_types.mod cp_log_handling.mod kinds.mod orbital_pointers.mod base_hooks.mod cp_dbcsr_output.mod cp_output_handling.mod ai_elec_field.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_elec_field.F qs_elec_field.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:44:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_elec_field.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_elec_field.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:57:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_elec_field.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_elec_field.F90 /build/reproducible-path/cp2k-8.1/src/qs_elec_field.F:198:13: 198 | IF (jatom /= last_jatom) THEN | ^ Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_elec_field.mod' due to: qs_elec_field.o /build/reproducible-path/cp2k-8.1/src/qs_elec_field.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod cp_para_types.mod input_section_types.mod particle_types.mod qs_kind_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cell_types.mod block_p_types.mod cp_log_handling.mod base_hooks.mod cp_dbcsr_output.mod cp_output_handling.mod orbital_pointers.mod kinds.mod ai_elec_field.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_elec_field.mod' due to: qs_elec_field.o /build/reproducible-path/cp2k-8.1/src/qs_elec_field.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cell_types.mod particle_types.mod block_p_types.mod input_section_types.mod cp_log_handling.mod kinds.mod orbital_pointers.mod base_hooks.mod cp_dbcsr_output.mod cp_output_handling.mod ai_elec_field.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_op.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_op.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod cp_fm_types.mod cp_cfm_types.mod input_section_types.mod mathconstants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod qs_spin_orbit.mod cp_fm_struct.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod cp_array_utils.mod cp_dbcsr_cp2k_link.mod qs_fermi_contact.mod particle_methods.mod cp_log_handling.mod base_hooks.mod qs_elec_field.mod qs_moments.mod orbital_pointers.mod qs_operators_ao.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_op.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_op.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_mo_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_cfm_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_fermi_contact.mod cp_gemm_interface.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod qs_spin_orbit.mod cp_fm_struct.mod qs_moments.mod cp_dbcsr_operations.mod cp_cfm_basic_linalg.mod cp_fm_basic_linalg.mod qs_elec_field.mod cp_array_utils.mod orbital_pointers.mod qs_operators_ao.mod particle_methods.mod base_hooks.mod mathconstants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_op.F qs_linres_op.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:44:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_op.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_op.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_op.mod' due to: qs_linres_op.o /build/reproducible-path/cp2k-8.1/src/qs_linres_op.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod cp_fm_types.mod cp_cfm_types.mod input_section_types.mod mathconstants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod qs_spin_orbit.mod cp_fm_struct.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod cp_array_utils.mod cp_dbcsr_cp2k_link.mod qs_fermi_contact.mod particle_methods.mod cp_log_handling.mod base_hooks.mod qs_elec_field.mod qs_moments.mod orbital_pointers.mod qs_operators_ao.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:58:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_op.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_op.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_op.mod' due to: qs_linres_op.o /build/reproducible-path/cp2k-8.1/src/qs_linres_op.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_mo_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_cfm_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_fermi_contact.mod cp_gemm_interface.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod qs_spin_orbit.mod cp_fm_struct.mod qs_moments.mod cp_dbcsr_operations.mod cp_cfm_basic_linalg.mod cp_fm_basic_linalg.mod qs_elec_field.mod cp_array_utils.mod orbital_pointers.mod qs_operators_ao.mod particle_methods.mod base_hooks.mod mathconstants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_atom_current.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_atom_current.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod qs_oce_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod paw_proj_set_types.mod qs_rho_atom_types.mod particle_types.mod qs_linres_types.mod sap_kind_types.mod atomic_kind_types.mod input_constants.mod util.mod kinds.mod qs_harmonics_atom.mod message_passing.mod qs_oce_methods.mod qs_grid_atom.mod qs_linres_op.mod cp_log_handling.mod base_hooks.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_atom_current.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_atom_current.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod sap_kind_types.mod particle_types.mod cell_types.mod qs_oce_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_linres_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_linres_op.mod cp_log_handling.mod kinds.mod qs_harmonics_atom.mod message_passing.mod qs_grid_atom.mod util.mod orbital_pointers.mod base_hooks.mod qs_oce_methods.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_atom_current.F qs_linres_atom_current.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:44:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_atom_current.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_atom_current.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_atom_current.mod' due to: qs_linres_atom_current.o /build/reproducible-path/cp2k-8.1/src/qs_linres_atom_current.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod qs_oce_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod paw_proj_set_types.mod qs_rho_atom_types.mod particle_types.mod qs_linres_types.mod sap_kind_types.mod atomic_kind_types.mod input_constants.mod util.mod kinds.mod qs_harmonics_atom.mod message_passing.mod qs_oce_methods.mod qs_grid_atom.mod qs_linres_op.mod cp_log_handling.mod base_hooks.mod orbital_pointers.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:58:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_atom_current.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_atom_current.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_atom_current.mod' due to: qs_linres_atom_current.o /build/reproducible-path/cp2k-8.1/src/qs_linres_atom_current.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod sap_kind_types.mod particle_types.mod cell_types.mod qs_oce_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_linres_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_linres_op.mod cp_log_handling.mod kinds.mod qs_harmonics_atom.mod message_passing.mod qs_grid_atom.mod util.mod orbital_pointers.mod base_hooks.mod qs_oce_methods.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_current.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_current.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod input_section_types.mod task_list_types.mod input_constants.mod task_list_methods.mod pw_methods.mod mathconstants.mod qs_linres_atom_current.mod cp_fm_struct.mod qs_matrix_pools.mod cube_utils.mod kinds.mod rs_pw_interface.mod grid_api.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod cp_array_utils.mod ao_util.mod gaussian_gridlevels.mod cp_dbcsr_cp2k_link.mod particle_methods.mod memory_utilities.mod qs_linres_op.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod orbital_pointers.mod qs_operators_ao.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_current.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_current.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod particle_list_types.mod cp_fm_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod task_list_types.mod realspace_grid_types.mod qs_linres_op.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod cube_utils.mod qs_matrix_pools.mod cp_realspace_grid_cube.mod task_list_methods.mod cp_fm_basic_linalg.mod memory_utilities.mod cp_array_utils.mod orbital_pointers.mod pw_methods.mod qs_operators_ao.mod particle_methods.mod rs_pw_interface.mod base_hooks.mod gaussian_gridlevels.mod mathconstants.mod ao_util.mod input_constants.mod qs_linres_atom_current.mod grid_api.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_current.F qs_linres_current.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:45:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_current.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_current.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:58:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_current.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_current.F90 /build/reproducible-path/cp2k-8.1/src/qs_linres_current.F:1289:37: 1289 | END FUNCTION encode_ardbmdarb_func @@ -44148,16 +44528,16 @@ /build/reproducible-path/cp2k-8.1/src/qs_linres_current.F:1450:56: Warning: 'MEM[(struct array03_box_type &)&box].dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/qs_linres_current.F:1450:56: Warning: 'MEM[(struct array03_box_type &)&box].dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/qs_linres_current.F:1450:56: Warning: 'MEM[(struct array03_box_type &)&box].dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_current.mod' due to: qs_linres_current.o /build/reproducible-path/cp2k-8.1/src/qs_linres_current.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod input_section_types.mod task_list_types.mod input_constants.mod task_list_methods.mod pw_methods.mod mathconstants.mod qs_linres_atom_current.mod cp_fm_struct.mod qs_matrix_pools.mod cube_utils.mod kinds.mod rs_pw_interface.mod grid_api.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod cp_array_utils.mod ao_util.mod gaussian_gridlevels.mod cp_dbcsr_cp2k_link.mod particle_methods.mod memory_utilities.mod qs_linres_op.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod orbital_pointers.mod qs_operators_ao.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_current.mod' due to: qs_linres_current.o /build/reproducible-path/cp2k-8.1/src/qs_linres_current.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod particle_list_types.mod cp_fm_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod task_list_types.mod realspace_grid_types.mod qs_linres_op.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod cube_utils.mod qs_matrix_pools.mod cp_realspace_grid_cube.mod task_list_methods.mod cp_fm_basic_linalg.mod memory_utilities.mod cp_array_utils.mod orbital_pointers.mod pw_methods.mod qs_operators_ao.mod particle_methods.mod rs_pw_interface.mod base_hooks.mod gaussian_gridlevels.mod mathconstants.mod ao_util.mod input_constants.mod qs_linres_atom_current.mod grid_api.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'transport.o' due to: /build/reproducible-path/cp2k-8.1/src/transport.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 transport_env_types.mod qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_kind_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod pw_pool_types.mod particle_list_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod pw_methods.mod kinds.mod qs_linres_current.mod cp_output_handling.mod physcon.mod message_passing.mod cp_dbcsr_cp2k_link.mod bibliography.mod particle_methods.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'transport.o' due to: /build/reproducible-path/cp2k-8.1/src/transport.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod particle_list_types.mod transport_env_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod bibliography.mod message_passing.mod cp_realspace_grid_cube.mod qs_linres_current.mod pw_methods.mod particle_methods.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/transport.F transport.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:45:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"transport.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' transport.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'transport.mod' due to: transport.o /build/reproducible-path/cp2k-8.1/src/transport.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 transport_env_types.mod qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_kind_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod pw_pool_types.mod particle_list_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod pw_methods.mod kinds.mod qs_linres_current.mod cp_output_handling.mod physcon.mod message_passing.mod cp_dbcsr_cp2k_link.mod bibliography.mod particle_methods.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:59:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"transport.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' transport.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'transport.mod' due to: transport.o /build/reproducible-path/cp2k-8.1/src/transport.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod particle_list_types.mod transport_env_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod bibliography.mod message_passing.mod cp_realspace_grid_cube.mod qs_linres_current.mod pw_methods.mod particle_methods.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_ddapc_types.mod qs_environment_types.mod cp_control_types.mod molecule_kind_types.mod cp_subsys_types.mod external_potential_types.mod semi_empirical_types.mod mp2_types.mod ewald_pw_types.mod input_section_types.mod qmmm_types_low.mod qs_wf_history_types.mod molecule_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod lri_environment_types.mod basis_set_types.mod cp_para_types.mod particle_types.mod semi_empirical_store_int_types.mod scf_control_types.mod ewald_environment_types.mod qs_force_types.mod qs_ks_types.mod qs_subsys_types.mod rel_control_types.mod et_coupling_types.mod qs_gcp_types.mod qs_dftb_types.mod hfx_types.mod ec_env_types.mod atomic_kind_types.mod xtb_types.mod qs_energy_types.mod qs_kind_types.mod qs_dispersion_types.mod qs_rho0_types.mod pw_env_types.mod qs_rho_atom_types.mod basis_set_container_types.mod fist_nonbond_env_types.mod qs_local_rho_types.mod semi_empirical_mpole_types.mod distribution_1d_types.mod global_types.mod multipole_types.mod mathconstants.mod header.mod qs_subsys_methods.mod kpoint_methods.mod qs_rho0_methods.mod ec_environment.mod almo_scf_env_methods.mod cp_log_handling.mod base_hooks.mod orbital_transformation_matrices.mod atom_kind_orbitals.mod machine.mod qs_rho_atom_methods.mod semi_empirical_expns3_methods.mod semi_empirical_int_arrays.mod qs_dftb_parameters.mod lri_environment_init.mod cp_control_utils.mod qs_environment_methods.mod cp_output_handling.mod xtb_parameters.mod qs_dispersion_pairpot.mod auto_basis.mod bibliography.mod particle_methods.mod kg_environment.mod qs_dispersion_nonloc.mod orbital_pointers.mod distribution_methods.mod kinds.mod mp2_setup.mod qs_interactions.mod hartree_local_methods.mod semi_empirical_utils.mod qs_wf_history_methods.mod qs_gcp_utils.mod qs_rho0_ggrid.mod cp_symmetry.mod dm_ls_scf_create.mod qs_dispersion_utils.mod input_constants.mod transport.mod cp_blacs_env.mod semi_empirical_mpole_methods.mod cp_para_env.mod gamma.mod ewald_pw_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rel_control_types.mod cp_para_types.mod semi_empirical_types.mod cp_subsys_types.mod kpoint_types.mod cell_types.mod qs_dispersion_types.mod qs_dftb_types.mod cp_ddapc_types.mod pw_env_types.mod qs_rho0_types.mod external_potential_types.mod qs_gcp_types.mod molecule_kind_types.mod semi_empirical_mpole_types.mod cp_control_types.mod ec_env_types.mod lri_environment_types.mod hfx_types.mod qs_ks_types.mod scf_control_types.mod particle_types.mod qs_force_types.mod semi_empirical_store_int_types.mod qs_local_rho_types.mod distribution_1d_types.mod qs_subsys_types.mod multipole_types.mod qmmm_types_low.mod qs_mo_types.mod atomic_kind_types.mod qs_environment_types.mod ewald_environment_types.mod ewald_pw_types.mod basis_set_container_types.mod qs_rho_atom_types.mod mp2_types.mod qs_wf_history_types.mod molecule_types.mod global_types.mod fist_nonbond_env_types.mod xtb_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod et_coupling_types.mod qs_energy_types.mod cp_output_handling.mod auto_basis.mod gamma.mod qs_rho_atom_methods.mod orbital_pointers.mod semi_empirical_int_arrays.mod dm_ls_scf_create.mod atom_kind_orbitals.mod qs_rho0_ggrid.mod qs_wf_history_methods.mod qs_interactions.mod ec_environment.mod semi_empirical_expns3_methods.mod qs_dispersion_utils.mod xtb_parameters.mod qs_gcp_utils.mod qs_dispersion_nonloc.mod ewald_pw_methods.mod particle_methods.mod distribution_methods.mod mathconstants.mod input_constants.mod kinds.mod qs_rho0_methods.mod orbital_transformation_matrices.mod cp_control_utils.mod cp_symmetry.mod semi_empirical_mpole_methods.mod bibliography.mod hartree_local_methods.mod cp_blacs_env.mod qs_dispersion_pairpot.mod mp2_setup.mod qs_environment_methods.mod lri_environment_init.mod kpoint_methods.mod qs_dftb_parameters.mod cp_log_handling.mod kg_environment.mod cp_para_env.mod semi_empirical_utils.mod almo_scf_env_methods.mod machine.mod qs_subsys_methods.mod transport.mod base_hooks.mod header.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_environment.F qs_environment.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:45:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_environment.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:59:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_environment.F90 /build/reproducible-path/cp2k-8.1/src/qs_environment.F:1197:87: 1197 | dispersion_env%parameter_file_name = dftb_control%dispersion_parameter_file @@ -44193,727 +44573,127 @@ 526 | TYPE(dftb_control_type), POINTER :: dftb_control | ^ note: 'dftb_control' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_environment.mod' due to: qs_environment.o /build/reproducible-path/cp2k-8.1/src/qs_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_ddapc_types.mod qs_environment_types.mod cp_control_types.mod molecule_kind_types.mod cp_subsys_types.mod external_potential_types.mod semi_empirical_types.mod mp2_types.mod ewald_pw_types.mod input_section_types.mod qmmm_types_low.mod qs_wf_history_types.mod molecule_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod lri_environment_types.mod basis_set_types.mod cp_para_types.mod particle_types.mod semi_empirical_store_int_types.mod scf_control_types.mod ewald_environment_types.mod qs_force_types.mod qs_ks_types.mod qs_subsys_types.mod rel_control_types.mod et_coupling_types.mod qs_gcp_types.mod qs_dftb_types.mod hfx_types.mod ec_env_types.mod atomic_kind_types.mod xtb_types.mod qs_energy_types.mod qs_kind_types.mod qs_dispersion_types.mod qs_rho0_types.mod pw_env_types.mod qs_rho_atom_types.mod basis_set_container_types.mod fist_nonbond_env_types.mod qs_local_rho_types.mod semi_empirical_mpole_types.mod distribution_1d_types.mod global_types.mod multipole_types.mod mathconstants.mod header.mod qs_subsys_methods.mod kpoint_methods.mod qs_rho0_methods.mod ec_environment.mod almo_scf_env_methods.mod cp_log_handling.mod base_hooks.mod orbital_transformation_matrices.mod atom_kind_orbitals.mod machine.mod qs_rho_atom_methods.mod semi_empirical_expns3_methods.mod semi_empirical_int_arrays.mod qs_dftb_parameters.mod lri_environment_init.mod cp_control_utils.mod qs_environment_methods.mod cp_output_handling.mod xtb_parameters.mod qs_dispersion_pairpot.mod auto_basis.mod bibliography.mod particle_methods.mod kg_environment.mod qs_dispersion_nonloc.mod orbital_pointers.mod distribution_methods.mod kinds.mod mp2_setup.mod qs_interactions.mod hartree_local_methods.mod semi_empirical_utils.mod qs_wf_history_methods.mod qs_gcp_utils.mod qs_rho0_ggrid.mod cp_symmetry.mod dm_ls_scf_create.mod qs_dispersion_utils.mod input_constants.mod transport.mod cp_blacs_env.mod semi_empirical_mpole_methods.mod cp_para_env.mod gamma.mod ewald_pw_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_environment.mod' due to: qs_environment.o /build/reproducible-path/cp2k-8.1/src/qs_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rel_control_types.mod cp_para_types.mod semi_empirical_types.mod cp_subsys_types.mod kpoint_types.mod cell_types.mod qs_dispersion_types.mod qs_dftb_types.mod cp_ddapc_types.mod pw_env_types.mod qs_rho0_types.mod external_potential_types.mod qs_gcp_types.mod molecule_kind_types.mod semi_empirical_mpole_types.mod cp_control_types.mod ec_env_types.mod lri_environment_types.mod hfx_types.mod qs_ks_types.mod scf_control_types.mod particle_types.mod qs_force_types.mod semi_empirical_store_int_types.mod qs_local_rho_types.mod distribution_1d_types.mod qs_subsys_types.mod multipole_types.mod qmmm_types_low.mod qs_mo_types.mod atomic_kind_types.mod qs_environment_types.mod ewald_environment_types.mod ewald_pw_types.mod basis_set_container_types.mod qs_rho_atom_types.mod mp2_types.mod qs_wf_history_types.mod molecule_types.mod global_types.mod fist_nonbond_env_types.mod xtb_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod et_coupling_types.mod qs_energy_types.mod cp_output_handling.mod auto_basis.mod gamma.mod qs_rho_atom_methods.mod orbital_pointers.mod semi_empirical_int_arrays.mod dm_ls_scf_create.mod atom_kind_orbitals.mod qs_rho0_ggrid.mod qs_wf_history_methods.mod qs_interactions.mod ec_environment.mod semi_empirical_expns3_methods.mod qs_dispersion_utils.mod xtb_parameters.mod qs_gcp_utils.mod qs_dispersion_nonloc.mod ewald_pw_methods.mod particle_methods.mod distribution_methods.mod mathconstants.mod input_constants.mod kinds.mod qs_rho0_methods.mod orbital_transformation_matrices.mod cp_control_utils.mod cp_symmetry.mod semi_empirical_mpole_methods.mod bibliography.mod hartree_local_methods.mod cp_blacs_env.mod qs_dispersion_pairpot.mod mp2_setup.mod qs_environment_methods.mod lri_environment_init.mod kpoint_methods.mod qs_dftb_parameters.mod cp_log_handling.mod kg_environment.mod cp_para_env.mod semi_empirical_utils.mod almo_scf_env_methods.mod machine.mod qs_subsys_methods.mod transport.mod base_hooks.mod header.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_read.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_read.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod cp_units.mod input_parsing.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_read.F input_cp2k_read.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:45:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_read.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_read.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_read.mod' due to: input_cp2k_read.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_read.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod cp_para_types.mod input_section_types.mod base_hooks.mod cp_units.mod input_parsing.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_links_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_links_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod particle_types.mod base_hooks.mod cp_log_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_links_methods.F qmmm_links_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:45:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_links_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_links_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_links_methods.mod' due to: qmmm_links_methods.o /build/reproducible-path/cp2k-8.1/src/qmmm_links_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod particle_types.mod base_hooks.mod cp_log_handling.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_fields_ext.o' due to: /build/reproducible-path/cp2k-8.1/src/force_fields_ext.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod cp_para_types.mod input_section_types.mod force_field_types.mod particle_types.mod cp_parser_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod memory_utilities.mod topology_amber.mod cp_output_handling.mod kinds.mod cp_units.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/force_fields_ext.F force_fields_ext.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:45:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields_ext.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields_ext.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_fields_ext.mod' due to: force_fields_ext.o /build/reproducible-path/cp2k-8.1/src/force_fields_ext.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod cp_para_types.mod input_section_types.mod force_field_types.mod particle_types.mod cp_parser_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod memory_utilities.mod topology_amber.mod cp_output_handling.mod kinds.mod cp_units.mod cp_parser_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_fields.o' due to: /build/reproducible-path/cp2k-8.1/src/force_fields.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod force_field_kind_types.mod cp_para_types.mod force_field_types.mod particle_types.mod molecule_kind_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod ewald_environment_types.mod molecule_types.mod input_constants.mod force_fields_util.mod kinds.mod force_fields_ext.mod force_fields_input.mod cp_output_handling.mod cp_log_handling.mod base_hooks.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/force_fields.F force_fields.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:45:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_fields.mod' due to: force_fields.o /build/reproducible-path/cp2k-8.1/src/force_fields.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod force_field_kind_types.mod cp_para_types.mod force_field_types.mod particle_types.mod molecule_kind_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod ewald_environment_types.mod molecule_types.mod input_constants.mod force_fields_util.mod kinds.mod force_fields_ext.mod force_fields_input.mod cp_output_handling.mod cp_log_handling.mod base_hooks.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_energy_types.mod fist_environment_types.mod cell_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod fist_nonbond_env_types.mod cp_subsys_types.mod exclusion_types.mod particle_list_types.mod distribution_1d_types.mod multipole_types.mod atomic_kind_types.mod ewald_pw_types.mod fist_efield_types.mod input_section_types.mod qmmm_types_low.mod ewald_environment_types.mod molecule_types.mod cell_methods.mod header.mod distribution_methods.mod force_fields.mod ewald_pw_methods.mod kinds.mod cp_output_handling.mod bibliography.mod cp_subsys_methods.mod particle_methods.mod cp_log_handling.mod cp_symmetry.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_environment.F fist_environment.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:45:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_environment.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_environment.mod' due to: fist_environment.o /build/reproducible-path/cp2k-8.1/src/fist_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_energy_types.mod fist_environment_types.mod cell_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod fist_nonbond_env_types.mod cp_subsys_types.mod exclusion_types.mod particle_list_types.mod distribution_1d_types.mod multipole_types.mod atomic_kind_types.mod ewald_pw_types.mod fist_efield_types.mod input_section_types.mod qmmm_types_low.mod ewald_environment_types.mod molecule_types.mod cell_methods.mod header.mod distribution_methods.mod force_fields.mod ewald_pw_methods.mod kinds.mod cp_output_handling.mod bibliography.mod cp_subsys_methods.mod particle_methods.mod cp_log_handling.mod cp_symmetry.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_gaussian_data.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_data.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_data.F qmmm_gaussian_data.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:45:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gaussian_data.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gaussian_data.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_gaussian_data.mod' due to: qmmm_gaussian_data.o /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_data.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_gaussian_input.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod string_utilities.mod cp_log_handling.mod mathconstants.mod base_hooks.mod qmmm_gaussian_data.mod kinds.mod physcon.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_input.F qmmm_gaussian_input.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:45:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gaussian_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gaussian_input.F90 -/build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_input.F:1079:101: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_core_matrix.o' due to: /build/reproducible-path/cp2k-8.1/src/se_core_matrix.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod virial_methods.mod cp_dbcsr_operations.mod cp_dbcsr_output.mod semi_empirical_utils.mod semi_empirical_int_arrays.mod base_hooks.mod qs_overlap.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_core_matrix.F se_core_matrix.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:59:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_core_matrix.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_core_matrix.F90 +/build/reproducible-path/cp2k-8.1/src/se_core_matrix.F:427:19: - 1079 | qmmm_gaussian_fns(IRad)%pgf%Gk(istart + 1:) = qmmm_gaussian_fns(IRad)%pgf%Gk(istart + 1:)*rc - | ^ -Warning: 'rc' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_input.F:654:101: + 427 | SUBROUTINE makeS(R, nra, nrb, ZSA, ZSB, ZPA, ZPB, S) + | ^ +Warning: 'makes' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/se_core_matrix.F:803:20: - 654 | qmmm_gaussian_fns(IRad)%pgf%Gk(istart + 1:) = qmmm_gaussian_fns(IRad)%pgf%Gk(istart + 1:)*rc - | ^ -Warning: 'rc' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_gaussian_input.mod' due to: qmmm_gaussian_input.o /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod string_utilities.mod cp_log_handling.mod mathconstants.mod base_hooks.mod qmmm_gaussian_data.mod kinds.mod physcon.mod cp_parser_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_gaussian_init.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod cp_para_types.mod input_section_types.mod pw_pool_types.mod pw_env_types.mod input_constants.mod ao_util.mod gaussian_gridlevels.mod cp_log_handling.mod qmmm_gaussian_input.mod base_hooks.mod qmmm_gaussian_data.mod cp_output_handling.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_init.F qmmm_gaussian_init.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gaussian_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gaussian_init.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_gaussian_init.mod' due to: qmmm_gaussian_init.o /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod cp_para_types.mod input_section_types.mod pw_pool_types.mod pw_env_types.mod input_constants.mod ao_util.mod gaussian_gridlevels.mod cp_log_handling.mod qmmm_gaussian_input.mod base_hooks.mod qmmm_gaussian_data.mod cp_output_handling.mod kinds.mod memory_utilities.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_elpot.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_elpot.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod input_section_types.mod qmmm_types_low.mod cell_types.mod input_constants.mod cp_log_handling.mod mathconstants.mod base_hooks.mod cp_output_handling.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_elpot.F qmmm_elpot.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_elpot.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_elpot.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_elpot.mod' due to: qmmm_elpot.o /build/reproducible-path/cp2k-8.1/src/qmmm_elpot.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod input_section_types.mod qmmm_types_low.mod cell_types.mod input_constants.mod cp_log_handling.mod mathconstants.mod base_hooks.mod cp_output_handling.mod kinds.mod memory_utilities.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_per_elpot.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_per_elpot.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod ewald_pw_types.mod cp_para_types.mod pw_poisson_types.mod input_section_types.mod qmmm_types_low.mod cell_types.mod ewald_environment_types.mod input_constants.mod ao_util.mod cp_log_handling.mod mathconstants.mod cp_output_handling.mod base_hooks.mod ewald_spline_util.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_per_elpot.F qmmm_per_elpot.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_per_elpot.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_per_elpot.F90 -/build/reproducible-path/cp2k-8.1/src/qmmm_per_elpot.F:187:54: + 803 | SUBROUTINE makedS(R, nra, nrb, ZSA, ZSB, ZPA, ZPB, dS) + | ^ +Warning: 'makeds' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/se_core_matrix.F:373:66: - 187 | LG(idim) = fs*LG(idim)*1.0_dp/Vol - | ^ -Warning: 'fs' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_per_elpot.mod' due to: qmmm_per_elpot.o /build/reproducible-path/cp2k-8.1/src/qmmm_per_elpot.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_gaussian_types.mod ewald_pw_types.mod cp_para_types.mod pw_poisson_types.mod input_section_types.mod qmmm_types_low.mod cell_types.mod ewald_environment_types.mod input_constants.mod ao_util.mod cp_log_handling.mod mathconstants.mod cp_output_handling.mod base_hooks.mod ewald_spline_util.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_init.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod pw_env_types.mod pair_potential_types.mod force_field_types.mod cp_control_types.mod qs_environment_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod external_potential_types.mod particle_list_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod input_constants.mod cell_methods.mod qmmm_gaussian_init.mod kinds.mod force_fields_input.mod qmmm_ff_fist.mod cp_output_handling.mod qmmm_elpot.mod qmmm_per_elpot.mod cp_log_handling.mod base_hooks.mod cp_units.mod cp_eri_mme_interface.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_init.F qmmm_init.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_init.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_init.mod' due to: qmmm_init.o /build/reproducible-path/cp2k-8.1/src/qmmm_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod pw_env_types.mod pair_potential_types.mod force_field_types.mod cp_control_types.mod qs_environment_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod external_potential_types.mod particle_list_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod input_constants.mod cell_methods.mod qmmm_gaussian_init.mod kinds.mod force_fields_input.mod qmmm_ff_fist.mod cp_output_handling.mod qmmm_elpot.mod qmmm_per_elpot.mod cp_log_handling.mod base_hooks.mod cp_units.mod cp_eri_mme_interface.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_pw_grid.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_pw_grid.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qmmm_types_low.mod pw_env_types.mod pw_grid_types.mod input_constants.mod base_hooks.mod message_passing.mod pw_grids.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_pw_grid.F qmmm_pw_grid.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_pw_grid.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_pw_grid.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_pw_grid.mod' due to: qmmm_pw_grid.o /build/reproducible-path/cp2k-8.1/src/qmmm_pw_grid.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qmmm_types_low.mod pw_env_types.mod pw_grid_types.mod input_constants.mod base_hooks.mod message_passing.mod pw_grids.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_create.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_create.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_environment_types.mod cell_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod fist_nonbond_env_types.mod cp_subsys_types.mod global_types.mod input_section_types.mod qmmm_types_low.mod qmmm_types.mod qs_environment.mod input_constants.mod cell_methods.mod header.mod qmmm_links_methods.mod kinds.mod fist_environment.mod cp_output_handling.mod qmmm_init.mod bibliography.mod cp_subsys_methods.mod cp_log_handling.mod base_hooks.mod qmmm_pw_grid.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_create.F qmmm_create.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:16 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_create.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_create.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_create.mod' due to: qmmm_create.o /build/reproducible-path/cp2k-8.1/src/qmmm_create.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_environment_types.mod cell_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod fist_nonbond_env_types.mod cp_subsys_types.mod global_types.mod input_section_types.mod qmmm_types_low.mod qmmm_types.mod qs_environment.mod input_constants.mod cell_methods.mod header.mod qmmm_links_methods.mod kinds.mod fist_environment.mod cp_output_handling.mod qmmm_init.mod bibliography.mod cp_subsys_methods.mod cp_log_handling.mod base_hooks.mod qmmm_pw_grid.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_util.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod input_section_types.mod qs_kind_types.mod cp_subsys_types.mod fist_environment_types.mod qmmm_types.mod force_env_types.mod cell_types.mod qs_environment_types.mod particle_types.mod input_constants.mod cp_log_handling.mod mathconstants.mod base_hooks.mod kinds.mod particle_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_util.F qmmm_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_util.mod' due to: qmmm_util.o /build/reproducible-path/cp2k-8.1/src/qmmm_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_energy_types.mod input_section_types.mod qs_kind_types.mod cp_subsys_types.mod fist_environment_types.mod qmmm_types.mod force_env_types.mod cell_types.mod qs_environment_types.mod particle_types.mod input_constants.mod cp_log_handling.mod mathconstants.mod base_hooks.mod kinds.mod particle_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmmx_util.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmmx_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qmmmx_types.mod cp_para_types.mod particle_types.mod fist_neighbor_list_types.mod cp_subsys_types.mod particle_list_types.mod molecule_list_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod qmmm_types.mod molecule_types.mod fist_neighbor_lists.mod kinds.mod qmmm_util.mod qmmm_ff_fist.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmmx_util.F qmmmx_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmmx_util.mod' due to: qmmmx_util.o /build/reproducible-path/cp2k-8.1/src/qmmmx_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qmmmx_types.mod cp_para_types.mod particle_types.mod fist_neighbor_list_types.mod cp_subsys_types.mod particle_list_types.mod molecule_list_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod qmmm_types.mod molecule_types.mod fist_neighbor_lists.mod kinds.mod qmmm_util.mod qmmm_ff_fist.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmmx_create.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmmx_create.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod qmmmx_types.mod cp_para_types.mod input_section_types.mod cp_subsys_types.mod qmmm_types.mod base_hooks.mod qmmm_create.mod qmmmx_util.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmmx_create.F qmmmx_create.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_create.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_create.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmmx_create.mod' due to: qmmmx_create.o /build/reproducible-path/cp2k-8.1/src/qmmmx_create.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod qmmmx_types.mod cp_para_types.mod input_section_types.mod cp_subsys_types.mod qmmm_types.mod base_hooks.mod qmmm_create.mod qmmmx_util.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'nnp_model.o' due to: /build/reproducible-path/cp2k-8.1/src/nnp_model.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod nnp_environment_types.mod base_hooks.mod cp_log_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/nnp_model.F nnp_model.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_model.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_model.F90 -/build/reproducible-path/cp2k-8.1/src/nnp_model.F:186:94: + 373 | force(jkind)%all_potential(:, atom_b) + force_ab(:) + | ^ +Warning: 'atom_b' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/se_core_matrix.F:371:66: - 186 | arc%layer(i)%node_grad(j) = -1.0_dp*arc%layer(i)%node(j)*arc%layer(i)%node_grad(j) - | ^ -Warning: 'j' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'nnp_model.mod' due to: nnp_model.o /build/reproducible-path/cp2k-8.1/src/nnp_model.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod nnp_environment_types.mod base_hooks.mod cp_log_handling.mod kinds.mod + 371 | force(ikind)%all_potential(:, atom_a) - force_ab(:) + | ^ +Warning: 'atom_a' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_core_matrix.mod' due to: se_core_matrix.o /build/reproducible-path/cp2k-8.1/src/se_core_matrix.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod virial_methods.mod cp_dbcsr_operations.mod cp_dbcsr_output.mod semi_empirical_utils.mod semi_empirical_int_arrays.mod base_hooks.mod qs_overlap.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'nnp_acsf.o' due to: /build/reproducible-path/cp2k-8.1/src/nnp_acsf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod nnp_environment_types.mod cell_types.mod periodic_table.mod cp_log_handling.mod mathconstants.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/nnp_acsf.F nnp_acsf.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_acsf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_acsf.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'nnp_acsf.mod' due to: nnp_acsf.o /build/reproducible-path/cp2k-8.1/src/nnp_acsf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod nnp_environment_types.mod cell_types.mod periodic_table.mod cp_log_handling.mod mathconstants.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_external_density.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_external_density.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pw_env_types.mod cp_control_types.mod pw_types.mod cell_types.mod qs_rho_types.mod input_section_types.mod realspace_grid_types.mod message_passing.mod gaussian_gridlevels.mod cp_files.mod kinds.mod pw_methods.mod rs_pw_interface.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_external_density.F qs_external_density.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:59:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_external_density.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_external_density.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_external_density.mod' due to: qs_external_density.o /build/reproducible-path/cp2k-8.1/src/qs_external_density.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pw_env_types.mod cp_control_types.mod pw_types.mod cell_types.mod qs_rho_types.mod input_section_types.mod realspace_grid_types.mod message_passing.mod gaussian_gridlevels.mod cp_files.mod kinds.mod pw_methods.mod rs_pw_interface.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'nnp_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/nnp_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod nnp_environment_types.mod cell_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod cell_methods.mod distribution_methods.mod kinds.mod cp_parser_methods.mod bibliography.mod cp_subsys_methods.mod particle_methods.mod periodic_table.mod cp_log_handling.mod base_hooks.mod nnp_model.mod nnp_acsf.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/nnp_environment.F nnp_environment.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_environment.F90 -/build/reproducible-path/cp2k-8.1/src/nnp_environment.F:734:68: - - 734 | WRITE (unit_nr, *) "NNP| NNP force environment initialized" - | ^ -Warning: 'unit_nr' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'nnp_environment.mod' due to: nnp_environment.o /build/reproducible-path/cp2k-8.1/src/nnp_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod nnp_environment_types.mod cell_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod cell_methods.mod distribution_methods.mod kinds.mod cp_parser_methods.mod bibliography.mod cp_subsys_methods.mod particle_methods.mod periodic_table.mod cp_log_handling.mod base_hooks.mod nnp_model.mod nnp_acsf.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'maxwell_solver_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/maxwell_solver_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod pw_types.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/maxwell_solver_interface.F maxwell_solver_interface.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:59:26 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"maxwell_solver_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' maxwell_solver_interface.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'maxwell_solver_interface.mod' due to: maxwell_solver_interface.o /build/reproducible-path/cp2k-8.1/src/maxwell_solver_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod pw_types.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod mixed_energy_types.mod cp_para_types.mod input_section_types.mod particle_types.mod cp_subsys_types.mod mixed_environment_types.mod cell_types.mod distribution_1d_types.mod cell_methods.mod base_hooks.mod cp_subsys_methods.mod distribution_methods.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_environment.F mixed_environment.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_environment.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_environment.mod' due to: mixed_environment.o /build/reproducible-path/cp2k-8.1/src/mixed_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod mixed_energy_types.mod cp_para_types.mod input_section_types.mod particle_types.mod cp_subsys_types.mod mixed_environment_types.mod cell_types.mod distribution_1d_types.mod cell_methods.mod base_hooks.mod cp_subsys_methods.mod distribution_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_external_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_external_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod qs_force_types.mod atomic_kind_types.mod qs_environment_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod message_passing.mod cp_realspace_grid_cube.mod string_utilities.mod base_hooks.mod force_fields_util.mod fparser.mod maxwell_solver_interface.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_external_potential.F qs_external_potential.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:59:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_external_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_external_potential.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_external_potential.mod' due to: qs_external_potential.o /build/reproducible-path/cp2k-8.1/src/qs_external_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod qs_force_types.mod atomic_kind_types.mod qs_environment_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod message_passing.mod cp_realspace_grid_cube.mod string_utilities.mod base_hooks.mod force_fields_util.mod fparser.mod maxwell_solver_interface.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_main.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_main.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod mixed_environment_types.mod mixed_environment.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod cp_files.mod cp_para_env.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_main.F mixed_main.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_main.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_main.F90 -/build/reproducible-path/cp2k-8.1/src/mixed_main.F:167:68: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_core_core.o' due to: /build/reproducible-path/cp2k-8.1/src/se_core_core.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod particle_types.mod cell_types.mod qs_force_types.mod atprop_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod virial_types.mod ewald_pw_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod virial_methods.mod message_passing.mod semi_empirical_utils.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_core_core.F se_core_core.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:59:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_core_core.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_core_core.F90 +/build/reproducible-path/cp2k-8.1/src/se_core_core.F:213:53: - 167 | mixed_env%sub_logger(i)%p%iter_info%project_name = c_val - | 1 -Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_main.mod' due to: mixed_main.o /build/reproducible-path/cp2k-8.1/src/mixed_main.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod mixed_environment_types.mod mixed_environment.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod cp_files.mod cp_para_env.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'restraint.o' due to: /build/reproducible-path/cp2k-8.1/src/restraint.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_kind_list_types.mod molecule_list_types.mod molecule_types.mod particle_types.mod colvar_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod cell_types.mod distribution_1d_types.mod base_hooks.mod message_passing.mod colvar_methods.mod constraint_fxd.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/restraint.F restraint.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:46:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"restraint.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' restraint.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'restraint.mod' due to: restraint.o /build/reproducible-path/cp2k-8.1/src/restraint.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_kind_list_types.mod molecule_list_types.mod molecule_types.mod particle_types.mod colvar_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod cell_types.mod distribution_1d_types.mod base_hooks.mod message_passing.mod colvar_methods.mod constraint_fxd.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint_vsite.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint_vsite.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_kind_list_types.mod molecule_list_types.mod molecule_types.mod particle_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/constraint_vsite.F constraint_vsite.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:47:00 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_vsite.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_vsite.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint_vsite.mod' due to: constraint_vsite.o /build/reproducible-path/cp2k-8.1/src/constraint_vsite.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_kind_list_types.mod molecule_list_types.mod molecule_types.mod particle_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod base_hooks.mod kinds.mod + 213 | dr3inv = -3.0_dp*rij*r3inv*r2inv + | ^ +Warning: 'r3inv' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/se_core_core.F:213:53: Warning: 'r2inv' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_core_core.mod' due to: se_core_core.o /build/reproducible-path/cp2k-8.1/src/se_core_core.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod particle_types.mod cell_types.mod qs_force_types.mod atprop_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod virial_types.mod ewald_pw_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod virial_methods.mod message_passing.mod semi_empirical_utils.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_cdft_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod cell_types.mod qs_kind_types.mod hirshfeld_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod pw_pool_types.mod cp_subsys_types.mod force_env_types.mod cp_fm_types.mod global_types.mod atomic_kind_types.mod mixed_cdft_types.mod input_section_types.mod mixed_environment_types.mod pw_grid_types.mod input_constants.mod cp_realspace_grid_init.mod pw_grids.mod cp_fm_struct.mod cp_blacs_env.mod cp_files.mod cube_utils.mod pw_env_methods.mod kinds.mod d3_poly.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_array_utils.mod gaussian_gridlevels.mod message_passing.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F mixed_cdft_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:47:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_cdft_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_cdft_utils.F90 -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:981:69: - - 981 | mixed_cdft%sub_logger(i)%p%iter_info%project_name = c_val - | 1 -Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1567:42: - - 1567 | nzeroed = nzeroed + 1 - | ^ -Warning: 'nzeroed' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1058:92: - - 1058 | TYPE(cp_fm_p_type), DIMENSION(:, :), POINTER :: matrix_p_tmp, mixed_matrix_p_tmp, & - | ^ -Warning: 'mixed_matrix_p_tmp.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1058:92: Warning: 'mixed_matrix_p_tmp.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1056:69: - - 1056 | TYPE(cp_1d_r_p_type), ALLOCATABLE, DIMENSION(:, :) :: occno_tmp - | ^ -Warning: 'occno_tmp.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1056:69: Warning: 'occno_tmp.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1058:72: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optimize_embedding_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/optimize_embedding_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod force_env_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod particle_list_types.mod cp_fm_types.mod embed_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod xc_rho_set_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod lri_environment_types.mod cp_log_handling.mod qs_kinetic.mod kinds.mod cp_gemm_interface.mod mixed_environment_utils.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_integrate_potential_single.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod qs_collocate_density.mod cp_fm_basic_linalg.mod cp_files.mod pw_methods.mod xc.mod cp_blacs_env.mod base_hooks.mod mathconstants.mod cp_fm_diag.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/optimize_embedding_potential.F optimize_embedding_potential.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:59:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_embedding_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_embedding_potential.F90 +/build/reproducible-path/cp2k-8.1/src/optimize_embedding_potential.F:1977:32: - 1058 | TYPE(cp_fm_p_type), DIMENSION(:, :), POINTER :: matrix_p_tmp, mixed_matrix_p_tmp, & - | ^ -Warning: 'matrix_p_tmp.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1058:72: Warning: 'matrix_p_tmp.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1064:74: + 1977 | SUBROUTINE inv_Hessian_update(grad, prev_grad, step, prev_inv_Hess, inv_Hess) + | ^ +Warning: 'inv_hessian_update' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/optimize_embedding_potential.F:2085:28: - 1064 | TYPE(dbcsr_p_type), DIMENSION(:, :), POINTER :: density_matrix, w_matrix - | ^ -Warning: 'density_matrix.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1064:74: Warning: 'density_matrix.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_cdft_utils.mod' due to: mixed_cdft_utils.o /build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod cell_types.mod qs_kind_types.mod hirshfeld_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod pw_pool_types.mod cp_subsys_types.mod force_env_types.mod cp_fm_types.mod global_types.mod atomic_kind_types.mod mixed_cdft_types.mod input_section_types.mod mixed_environment_types.mod pw_grid_types.mod input_constants.mod cp_realspace_grid_init.mod pw_grids.mod cp_fm_struct.mod cp_blacs_env.mod cp_files.mod cube_utils.mod pw_env_methods.mod kinds.mod d3_poly.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_array_utils.mod gaussian_gridlevels.mod message_passing.mod cp_log_handling.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_cdft_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod hirshfeld_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod cp_fm_types.mod atomic_kind_types.mod mixed_cdft_types.mod input_section_types.mod mixed_environment_types.mod qs_energy_types.mod input_constants.mod pw_methods.mod cp_gemm_interface.mod cp_fm_struct.mod mixed_cdft_utils.mod util.mod cp_dbcsr_diag.mod kinds.mod qs_mo_io.mod grid_api.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod cp_array_utils.mod ao_util.mod message_passing.mod hirshfeld_methods.mod memory_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod qs_mo_methods.mod machine.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F mixed_cdft_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:47:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_cdft_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_cdft_methods.F90 -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:2034:40: + 2085 | SUBROUTINE Hessian_update(grad, prev_grad, step, prev_Hess, Hess) + | ^ +Warning: 'hessian_update' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/optimize_embedding_potential.F:3430:40: - 2034 | metric(:, :) = metric(:, :)/4.0_dp + 3430 | CALL pw_release(pot_beta%pw) | ^ -Warning: 'density_matrix_diff.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1188:95: - - 1188 | TYPE(dbcsr_p_type), DIMENSION(:, :), POINTER :: density_matrix, density_matrix_diff, & - | ^ -note: 'density_matrix_diff.dim[1].ubound' was declared here -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1188:95: Warning: 'density_matrix_diff.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1188:95: Warning: 'density_matrix_diff.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1171:64: - - 1171 | INTEGER, ALLOCATABLE, DIMENSION(:, :) :: homo - | ^ -Warning: 'homo.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1171:64: Warning: 'homo.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1171:64: Warning: 'homo.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1188:74: - - 1188 | TYPE(dbcsr_p_type), DIMENSION(:, :), POINTER :: density_matrix, density_matrix_diff, & - | ^ -Warning: 'density_matrix.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1509:84: - - 1509 | density_matrix(jstate, ispin)%matrix, -1.0_dp, 1.0_dp) - | ^ -Warning: 'density_matrix.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1188:74: - - 1188 | TYPE(dbcsr_p_type), DIMENSION(:, :), POINTER :: density_matrix, density_matrix_diff, & - | ^ -Warning: 'density_matrix.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3449:13: - - 3449 | IF (ANY(mask_send)) THEN - | ^ -Warning: 'mask_send.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:2764:80: - - 2764 | LOGICAL, DIMENSION(:), POINTER :: mask_recv, mask_send, touched - | ^ -note: 'mask_send.dim[0].ubound' was declared here -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3466:13: - - 3466 | IF (ANY(mask_recv)) THEN - | ^ -Warning: 'mask_recv.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:2764:69: - - 2764 | LOGICAL, DIMENSION(:), POINTER :: mask_recv, mask_send, touched - | ^ -note: 'mask_recv.dim[0].ubound' was declared here -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3401:97: - - 3401 | ALLOCATE (req_total(COUNT(mixed_cdft%dlb_control%recv_work_repl) + 2*COUNT(touched))) - | ^ -Warning: 'touched.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:2764:89: - - 2764 | LOGICAL, DIMENSION(:), POINTER :: mask_recv, mask_send, touched - | ^ -note: 'touched.dim[0].ubound' was declared here -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:2830:93: - - 2830 | REAL(bo(2, 1) - bo(1, 1) + 1, dp)) - | ^ -Warning: 'my_work_size' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:2309:44: - - 2309 | jatom, katom, my_work, my_work_size, natom, nforce_eval, nkind, np(3), npme, nthread, & - | ^ -note: 'my_work_size' was declared here -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: - - 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight - | ^ -Warning: 'weight.dim[2].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3877:61: - - 3877 | DO i = LBOUND(weight, 3), UBOUND(weight, 3) - | ^ -Warning: 'weight.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: - - 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight - | ^ -note: 'weight.dim[2].lbound' was declared here -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3877:61: - - 3877 | DO i = LBOUND(weight, 3), UBOUND(weight, 3) - | ^ -Warning: 'weight.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: - - 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight - | ^ -note: 'weight.dim[2].stride' was declared here -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: 'weight.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3829:58: - - 3829 | DO j = LBOUND(weight, 2), UBOUND(weight, 2) - | ^ -Warning: 'weight.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: - - 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight - | ^ -note: 'weight.dim[1].lbound' was declared here -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3829:58: - - 3829 | DO j = LBOUND(weight, 2), UBOUND(weight, 2) - | ^ -Warning: 'weight.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: - - 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight - | ^ -note: 'weight.dim[1].stride' was declared here -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: 'weight.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: 'weight.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: 'weight.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: 'weight.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: - - 3555 | REAL(KIND=dp), DIMENSION(:, :, :, :), POINTER :: gradients - | ^ -Warning: 'gradients.dim[3].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: Warning: 'gradients.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: Warning: 'gradients.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: Warning: 'gradients.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: Warning: 'gradients.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:66: - - 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight - | ^ -Warning: 'cavity.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:66: Warning: 'cavity.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:66: Warning: 'cavity.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:66: Warning: 'cavity.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3549:68: - - 3549 | REAL(kind=dp), ALLOCATABLE, DIMENSION(:, :, :) :: dP_i_dRj - | ^ -Warning: 'dp_i_drj.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3549:68: Warning: 'dp_i_drj.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3891:41: - - 3891 | dP_i_dRi = 0.0_dp - | ^ -Warning: 'dp_i_dri.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3548:83: - - 3548 | distance_vecs, dP_i_dRi - | ^ -note: 'dp_i_dri.dim[1].ubound' was declared here -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3889:44: - - 3889 | d_sum_Pm_dR = 0.0_dp - | ^ -Warning: 'd_sum_pm_dr.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3547:87: - - 3547 | REAL(kind=dp), ALLOCATABLE, DIMENSION(:, :) :: d_sum_const_dR, d_sum_Pm_dR, & - | ^ -note: 'd_sum_pm_dr.dim[1].ubound' was declared here -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3890:47: - - 3890 | d_sum_const_dR = 0.0_dp - | ^ -Warning: 'd_sum_const_dr.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3547:74: - - 3547 | REAL(kind=dp), ALLOCATABLE, DIMENSION(:, :) :: d_sum_const_dR, d_sum_Pm_dR, & - | ^ -note: 'd_sum_const_dr.dim[1].ubound' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_cdft_methods.mod' due to: mixed_cdft_methods.o /build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod hirshfeld_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod cp_fm_types.mod atomic_kind_types.mod mixed_cdft_types.mod input_section_types.mod mixed_environment_types.mod qs_energy_types.mod input_constants.mod pw_methods.mod cp_gemm_interface.mod cp_fm_struct.mod mixed_cdft_utils.mod util.mod cp_dbcsr_diag.mod kinds.mod qs_mo_io.mod grid_api.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod cp_array_utils.mod ao_util.mod message_passing.mod hirshfeld_methods.mod memory_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod qs_mo_methods.mod machine.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'nnp_force.o' due to: /build/reproducible-path/cp2k-8.1/src/nnp_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod input_section_types.mod nnp_environment_types.mod particle_types.mod cp_subsys_types.mod distribution_1d_types.mod periodic_table.mod cp_log_handling.mod message_passing.mod base_hooks.mod physcon.mod nnp_model.mod cp_output_handling.mod nnp_acsf.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/nnp_force.F nnp_force.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:48:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_force.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'nnp_force.mod' due to: nnp_force.o /build/reproducible-path/cp2k-8.1/src/nnp_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod input_section_types.mod nnp_environment_types.mod particle_types.mod cp_subsys_types.mod distribution_1d_types.mod periodic_table.mod cp_log_handling.mod message_passing.mod base_hooks.mod physcon.mod nnp_model.mod cp_output_handling.mod nnp_acsf.mod cp_units.mod kinds.mod +Warning: 'pot_beta' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optimize_embedding_potential.mod' due to: optimize_embedding_potential.o /build/reproducible-path/cp2k-8.1/src/optimize_embedding_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod force_env_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod particle_list_types.mod cp_fm_types.mod embed_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod xc_rho_set_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod lri_environment_types.mod cp_log_handling.mod qs_kinetic.mod kinds.mod cp_gemm_interface.mod mixed_environment_utils.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_integrate_potential_single.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod qs_collocate_density.mod cp_fm_basic_linalg.mod cp_files.mod pw_methods.mod xc.mod cp_blacs_env.mod base_hooks.mod mathconstants.mod cp_fm_diag.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_tb_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_dftb_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_ks_qmmm_types.mod pw_poisson_types.mod atomic_kind_types.mod ewald_pw_types.mod input_section_types.mod xtb_types.mod qmmm_types_low.mod ewald_environment_types.mod qs_ks_types.mod input_constants.mod qs_dftb_matrices.mod mulliken.mod kinds.mod qmmm_util.mod qs_dftb_coulomb.mod cp_dbcsr_operations.mod qs_dftb_utils.mod spme.mod message_passing.mod qs_overlap.mod base_hooks.mod qs_neighbor_lists.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F qmmm_tb_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:48:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_tb_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_tb_methods.F90 -/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:1395:37: - - 1395 | force_ab = -fsr*rij/dr - | ^ -Warning: 'fsr' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:895:13: - - 895 | IF (do_dftb) THEN - | ^ -Warning: 'do_dftb' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:897:17: - - 897 | ELSEIF (do_xtb) THEN - | ^ -Warning: 'do_xtb' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:652:13: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_gcp_method.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod atprop_types.mod qs_environment_types.mod qs_neighbor_list_types.mod virial_types.mod qs_kind_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_gcp_types.mod atomic_kind_types.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod physcon.mod ai_overlap.mod virial_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F qs_gcp_method.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:59:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gcp_method.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gcp_method.F90 +/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:286:13: - 652 | IF (do_dftb) THEN + 286 | IF (use_virial) THEN | ^ -Warning: 'do_dftb' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:654:17: - - 654 | ELSEIF (do_xtb) THEN - | ^ -Warning: 'do_xtb' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:377:10: - - 377 | IF (do_dftb) THEN - | ^ -Warning: 'do_dftb' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:379:14: - - 379 | ELSEIF (do_xtb) THEN - | ^ -Warning: 'do_xtb' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:277:10: - - 277 | IF (do_dftb) THEN - | ^ -Warning: 'do_dftb' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:279:14: - - 279 | ELSEIF (do_xtb) THEN - | ^ -Warning: 'do_xtb' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:161:10: - - 161 | IF (do_dftb) THEN - | ^ -Warning: 'do_dftb' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F:163:14: - - 163 | ELSEIF (do_xtb) THEN - | ^ -Warning: 'do_xtb' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_tb_methods.mod' due to: qmmm_tb_methods.o /build/reproducible-path/cp2k-8.1/src/qmmm_tb_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_dftb_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_ks_qmmm_types.mod pw_poisson_types.mod atomic_kind_types.mod ewald_pw_types.mod input_section_types.mod xtb_types.mod qmmm_types_low.mod ewald_environment_types.mod qs_ks_types.mod input_constants.mod qs_dftb_matrices.mod mulliken.mod kinds.mod qmmm_util.mod qs_dftb_coulomb.mod cp_dbcsr_operations.mod qs_dftb_utils.mod spme.mod message_passing.mod qs_overlap.mod base_hooks.mod qs_neighbor_lists.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mm_collocate_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/mm_collocate_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod ao_util.mod base_hooks.mod cube_utils.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mm_collocate_potential.F mm_collocate_potential.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:48:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mm_collocate_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mm_collocate_potential.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mm_collocate_potential.mod' due to: mm_collocate_potential.o /build/reproducible-path/cp2k-8.1/src/mm_collocate_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod ao_util.mod base_hooks.mod cube_utils.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_se_energy.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_se_energy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_ks_qmmm_types.mod semi_empirical_types.mod multipole_types.mod atomic_kind_types.mod qmmm_types_low.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod kinds.mod qmmm_util.mod cp_output_handling.mod cp_dbcsr_operations.mod semi_empirical_utils.mod message_passing.mod qs_overlap.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod qs_neighbor_lists.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_se_energy.F qmmm_se_energy.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:48:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_se_energy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_se_energy.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_se_energy.mod' due to: qmmm_se_energy.o /build/reproducible-path/cp2k-8.1/src/qmmm_se_energy.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_ks_qmmm_types.mod semi_empirical_types.mod multipole_types.mod atomic_kind_types.mod qmmm_types_low.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod kinds.mod qmmm_util.mod cp_output_handling.mod cp_dbcsr_operations.mod semi_empirical_utils.mod message_passing.mod qs_overlap.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod qs_neighbor_lists.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_gpw_energy.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_gpw_energy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_subsys_types.mod cell_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_ks_qmmm_types.mod pw_pool_types.mod particle_list_types.mod qmmm_gaussian_types.mod input_section_types.mod qmmm_types_low.mod input_constants.mod pw_methods.mod qmmm_tb_methods.mod cube_utils.mod kinds.mod qmmm_util.mod cp_output_handling.mod cp_spline_utils.mod message_passing.mod mm_collocate_potential.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod qmmm_se_energy.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_gpw_energy.F qmmm_gpw_energy.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:48:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gpw_energy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gpw_energy.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_gpw_energy.mod' due to: qmmm_gpw_energy.o /build/reproducible-path/cp2k-8.1/src/qmmm_gpw_energy.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_subsys_types.mod cell_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_ks_qmmm_types.mod pw_pool_types.mod particle_list_types.mod qmmm_gaussian_types.mod input_section_types.mod qmmm_types_low.mod input_constants.mod pw_methods.mod qmmm_tb_methods.mod cube_utils.mod kinds.mod qmmm_util.mod cp_output_handling.mod cp_spline_utils.mod message_passing.mod mm_collocate_potential.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod qmmm_se_energy.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewalds.o' due to: /build/reproducible-path/cp2k-8.1/src/ewalds.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dg_types.mod shell_potential_types.mod cell_types.mod particle_types.mod dg_rho0_types.mod pw_poisson_types.mod pw_pool_types.mod structure_factor_types.mod distribution_1d_types.mod atomic_kind_types.mod ewald_pw_types.mod ewald_environment_types.mod pw_grid_types.mod mathconstants.mod kinds.mod message_passing.mod bibliography.mod mathlib.mod base_hooks.mod structure_factors.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewalds.F ewalds.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:48:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewalds.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewalds.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewalds.mod' due to: ewalds.o /build/reproducible-path/cp2k-8.1/src/ewalds.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dg_types.mod shell_potential_types.mod cell_types.mod particle_types.mod dg_rho0_types.mod pw_poisson_types.mod pw_pool_types.mod structure_factor_types.mod distribution_1d_types.mod atomic_kind_types.mod ewald_pw_types.mod ewald_environment_types.mod pw_grid_types.mod mathconstants.mod kinds.mod message_passing.mod bibliography.mod mathlib.mod base_hooks.mod structure_factors.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'manybody_tersoff.o' due to: /build/reproducible-path/cp2k-8.1/src/manybody_tersoff.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod mathlib.mod base_hooks.mod mathconstants.mod util.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/manybody_tersoff.F manybody_tersoff.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:48:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_tersoff.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_tersoff.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'manybody_tersoff.mod' due to: manybody_tersoff.o /build/reproducible-path/cp2k-8.1/src/manybody_tersoff.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod mathlib.mod base_hooks.mod mathconstants.mod util.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'manybody_siepmann.o' due to: /build/reproducible-path/cp2k-8.1/src/manybody_siepmann.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod atomic_kind_types.mod cp_para_types.mod input_section_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod particle_types.mod mathlib.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod util.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/manybody_siepmann.F manybody_siepmann.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:48:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_siepmann.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_siepmann.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'manybody_siepmann.mod' due to: manybody_siepmann.o /build/reproducible-path/cp2k-8.1/src/manybody_siepmann.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod atomic_kind_types.mod cp_para_types.mod input_section_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod particle_types.mod mathlib.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod util.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'manybody_quip.o' due to: /build/reproducible-path/cp2k-8.1/src/manybody_quip.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod atomic_kind_types.mod cp_para_types.mod pair_potential_types.mod cell_types.mod particle_types.mod cp_log_handling.mod base_hooks.mod bibliography.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/manybody_quip.F manybody_quip.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:48:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_quip.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_quip.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'manybody_quip.mod' due to: manybody_quip.o /build/reproducible-path/cp2k-8.1/src/manybody_quip.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod atomic_kind_types.mod cp_para_types.mod pair_potential_types.mod cell_types.mod particle_types.mod cp_log_handling.mod base_hooks.mod bibliography.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'manybody_gal.o' due to: /build/reproducible-path/cp2k-8.1/src/manybody_gal.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod atomic_kind_types.mod cp_para_types.mod input_section_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod particle_types.mod mathlib.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod util.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/manybody_gal.F manybody_gal.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:48:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_gal.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_gal.F90 -/build/reproducible-path/cp2k-8.1/src/manybody_gal.F:171:126: - - 171 | - gal%bxy*drji2*sinalpha*sinalpha)) - | ^ -Warning: 'sinalpha' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/manybody_gal.F:171:126: Warning: 'cosalpha' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/manybody_gal.F:172:33: - - 172 | IF (weight == 0 .AND. index_outfile > 0) WRITE (index_outfile, *) "Fermi 0" - | ^ -Warning: 'weight' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'manybody_gal.mod' due to: manybody_gal.o /build/reproducible-path/cp2k-8.1/src/manybody_gal.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod atomic_kind_types.mod cp_para_types.mod input_section_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod particle_types.mod mathlib.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod util.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'manybody_eam.o' due to: /build/reproducible-path/cp2k-8.1/src/manybody_eam.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod cp_para_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod particle_types.mod mathlib.mod base_hooks.mod message_passing.mod bibliography.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/manybody_eam.F manybody_eam.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:48:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_eam.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_eam.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'manybody_eam.mod' due to: manybody_eam.o /build/reproducible-path/cp2k-8.1/src/manybody_eam.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod cp_para_types.mod fist_neighbor_list_types.mod pair_potential_types.mod cell_types.mod particle_types.mod mathlib.mod base_hooks.mod message_passing.mod bibliography.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'manybody_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/manybody_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod pair_potential_types.mod particle_types.mod fist_nonbond_env_types.mod fist_neighbor_list_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod manybody_tersoff.mod util.mod kinds.mod manybody_siepmann.mod message_passing.mod manybody_quip.mod mathlib.mod base_hooks.mod manybody_gal.mod manybody_eam.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/manybody_potential.F manybody_potential.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:48:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_potential.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'manybody_potential.mod' due to: manybody_potential.o /build/reproducible-path/cp2k-8.1/src/manybody_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod pair_potential_types.mod particle_types.mod fist_nonbond_env_types.mod fist_neighbor_list_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod manybody_tersoff.mod util.mod kinds.mod manybody_siepmann.mod message_passing.mod manybody_quip.mod mathlib.mod base_hooks.mod manybody_gal.mod manybody_eam.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_pol_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_pol_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod multipole_types.mod atomic_kind_types.mod ewald_pw_types.mod pw_poisson_types.mod fist_energy_types.mod input_section_types.mod particle_types.mod cell_types.mod ewald_environment_types.mod distribution_1d_types.mod input_constants.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod ewalds_multipole.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_pol_scf.F fist_pol_scf.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:48:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_pol_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_pol_scf.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_pol_scf.mod' due to: fist_pol_scf.o /build/reproducible-path/cp2k-8.1/src/fist_pol_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_nonbond_env_types.mod multipole_types.mod atomic_kind_types.mod ewald_pw_types.mod pw_poisson_types.mod fist_energy_types.mod input_section_types.mod particle_types.mod cell_types.mod ewald_environment_types.mod distribution_1d_types.mod input_constants.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod ewalds_multipole.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_nonbond_force.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod splines_types.mod pair_potential_types.mod particle_types.mod fist_nonbond_env_types.mod fist_neighbor_list_types.mod atprop_types.mod distribution_1d_types.mod atomic_kind_types.mod ewald_environment_types.mod pair_potential_coulomb.mod mathconstants.mod kinds.mod message_passing.mod mathlib.mod cp_log_handling.mod base_hooks.mod splines_methods.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F fist_nonbond_force.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:49:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_nonbond_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_nonbond_force.F90 -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:442:96: - - 442 | ei_interaction_cutoffs(2, kind_a, kind_b)) - | ^ -Warning: 'qcore_b' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:110:60: - - 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & - | ^ -note: 'qcore_b' was declared here -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:399:96: - - 399 | ei_interaction_cutoffs(1, kind_a, kind_b)) - | ^ -Warning: 'qcore_a' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:110:51: - - 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & - | ^ -note: 'qcore_a' was declared here -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:419:96: - - 419 | ei_interaction_cutoffs(3, kind_a, kind_b)) - | ^ -Warning: 'qshell_b' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:110:96: - - 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & - | ^ -note: 'qshell_b' was declared here -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:419:96: - - 419 | ei_interaction_cutoffs(3, kind_a, kind_b)) - | ^ -Warning: 'qshell_a' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:110:86: - - 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & - | ^ -note: 'qshell_a' was declared here -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:478:96: - - 478 | ei_interaction_cutoffs(3, kind_a, kind_b)) - | ^ -Warning: 'qeff_b' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:110:76: - - 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & - | ^ -note: 'qeff_b' was declared here -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:460:96: - - 460 | ei_interaction_cutoffs(3, kind_a, kind_b)) - | ^ -Warning: 'qeff_a' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:110:68: - - 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & - | ^ -note: 'qeff_a' was declared here -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:533:31: - - 533 | !$OMP ATOMIC - | ^ -Warning: 'shell_b' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:104:59: - - 104 | j, kind_a, kind_b, nkind, npairs, shell_a, shell_b, shell_type - | ^ -note: 'shell_b' was declared here -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:525:31: - - 525 | !$OMP ATOMIC - | ^ -Warning: 'shell_a' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:104:50: - - 104 | j, kind_a, kind_b, nkind, npairs, shell_a, shell_b, shell_type - | ^ -note: 'shell_a' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_nonbond_force.mod' due to: fist_nonbond_force.o /build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod splines_types.mod pair_potential_types.mod particle_types.mod fist_nonbond_env_types.mod fist_neighbor_list_types.mod atprop_types.mod distribution_1d_types.mod atomic_kind_types.mod ewald_environment_types.mod pair_potential_coulomb.mod mathconstants.mod kinds.mod message_passing.mod mathlib.mod cp_log_handling.mod base_hooks.mod splines_methods.mod machine.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pme.o' due to: /build/reproducible-path/cp2k-8.1/src/pme.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dg_types.mod realspace_grid_types.mod shell_potential_types.mod pw_types.mod cell_types.mod particle_types.mod dg_rho0_types.mod pw_poisson_types.mod pw_pool_types.mod structure_factor_types.mod atprop_types.mod atomic_kind_types.mod ewald_pw_types.mod ewald_environment_types.mod pw_grid_types.mod pw_methods.mod mathconstants.mod kinds.mod pw_poisson_methods.mod pme_tools.mod dgs.mod bibliography.mod base_hooks.mod structure_factors.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pme.F pme.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:49:10 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pme.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pme.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pme.mod' due to: pme.o /build/reproducible-path/cp2k-8.1/src/pme.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dg_types.mod realspace_grid_types.mod shell_potential_types.mod pw_types.mod cell_types.mod particle_types.mod dg_rho0_types.mod pw_poisson_types.mod pw_pool_types.mod structure_factor_types.mod atprop_types.mod atomic_kind_types.mod ewald_pw_types.mod ewald_environment_types.mod pw_grid_types.mod pw_methods.mod mathconstants.mod kinds.mod pw_poisson_methods.mod pme_tools.mod dgs.mod bibliography.mod base_hooks.mod structure_factors.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_efield_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_efield_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_efield_types.mod cp_result_types.mod input_section_types.mod fist_environment_types.mod cell_types.mod particle_types.mod mathconstants.mod moments_utils.mod base_hooks.mod physcon.mod cp_result_methods.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_efield_methods.F fist_efield_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:49:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_efield_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_efield_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_efield_methods.mod' due to: fist_efield_methods.o /build/reproducible-path/cp2k-8.1/src/fist_efield_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod fist_efield_types.mod cp_result_types.mod input_section_types.mod fist_environment_types.mod cell_types.mod particle_types.mod mathconstants.mod moments_utils.mod base_hooks.mod physcon.mod cp_result_methods.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mol_force.o' due to: /build/reproducible-path/cp2k-8.1/src/mol_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mol_force.F mol_force.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:49:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mol_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mol_force.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mol_force.mod' due to: mol_force.o /build/reproducible-path/cp2k-8.1/src/mol_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_intra_force.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_intra_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod particle_types.mod atprop_types.mod cell_types.mod distribution_1d_types.mod cp_log_handling.mod base_hooks.mod mol_force.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_intra_force.F fist_intra_force.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:49:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_intra_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_intra_force.F90 -/build/reproducible-path/cp2k-8.1/src/fist_intra_force.F:119:64: - - 119 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: pv_a - | ^ -Warning: 'pv_a.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/fist_intra_force.F:119:64: Warning: 'pv_a.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/fist_intra_force.F:414:88: - - 414 | CALL get_pv_torsion(k1, k3, k4, t12, t32, t43, pv_a(:, :, index_d)) - | ^ -Warning: 'pv_a.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/fist_intra_force.F:118:66: - - 118 | REAL(KIND=dp), DIMENSION(:), POINTER :: ener_a - | ^ -Warning: 'ener_a.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/fist_intra_force.F:118:66: Warning: 'ener_a.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/fist_intra_force.F:387:71: +Warning: 'use_virial' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:236:80: - 387 | ener_a(index_d) = ener_a(index_d) + energy*0.25_dp - | ^ -Warning: 'ener_a.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_intra_force.mod' due to: fist_intra_force.o /build/reproducible-path/cp2k-8.1/src/fist_intra_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod particle_types.mod atprop_types.mod cell_types.mod distribution_1d_types.mod cp_log_handling.mod base_hooks.mod mol_force.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_force.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod fist_energy_types.mod fist_environment_types.mod cell_types.mod cp_para_types.mod virial_types.mod particle_types.mod molecule_kind_types.mod fist_nonbond_env_types.mod pw_poisson_types.mod cp_subsys_types.mod atprop_types.mod exclusion_types.mod distribution_1d_types.mod multipole_types.mod atomic_kind_types.mod ewald_pw_types.mod fist_efield_types.mod input_section_types.mod ewald_environment_types.mod molecule_types.mod input_constants.mod ewalds.mod manybody_potential.mod ewald_pw_methods.mod kinds.mod fist_pol_scf.mod fist_nonbond_force.mod pme.mod fist_efield_methods.mod cp_output_handling.mod ewalds_multipole.mod spme.mod message_passing.mod cp_log_handling.mod fist_intra_force.mod base_hooks.mod fist_neighbor_list_control.mod manybody_eam.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_force.F fist_force.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:49:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_force.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_force.mod' due to: fist_force.o /build/reproducible-path/cp2k-8.1/src/fist_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod fist_energy_types.mod fist_environment_types.mod cell_types.mod cp_para_types.mod virial_types.mod particle_types.mod molecule_kind_types.mod fist_nonbond_env_types.mod pw_poisson_types.mod cp_subsys_types.mod atprop_types.mod exclusion_types.mod distribution_1d_types.mod multipole_types.mod atomic_kind_types.mod ewald_pw_types.mod fist_efield_types.mod input_section_types.mod ewald_environment_types.mod molecule_types.mod input_constants.mod ewalds.mod manybody_potential.mod ewald_pw_methods.mod kinds.mod fist_pol_scf.mod fist_nonbond_force.mod pme.mod fist_efield_methods.mod cp_output_handling.mod ewalds_multipole.mod spme.mod message_passing.mod cp_log_handling.mod fist_intra_force.mod base_hooks.mod fist_neighbor_list_control.mod manybody_eam.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_se_forces.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_se_forces.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_ks_qmmm_types.mod semi_empirical_types.mod multipole_types.mod atomic_kind_types.mod qmmm_types_low.mod input_constants.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod kinds.mod qmmm_util.mod semi_empirical_utils.mod message_passing.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_se_forces.F qmmm_se_forces.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:49:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_se_forces.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_se_forces.F90 -/build/reproducible-path/cp2k-8.1/src/qmmm_se_forces.F:209:17: + 236 | CALL virial_pair_force(atstr(:, :, iatom), -0.5_dp, fdij, rij) + | ^ +Warning: 'atstr.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:236:80: Warning: 'atstr.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:237:80: - 209 | CPASSERT(iqm == number_qm_atoms) - | ^ -Warning: 'iqm' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_se_forces.mod' due to: qmmm_se_forces.o /build/reproducible-path/cp2k-8.1/src/qmmm_se_forces.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_ks_qmmm_types.mod semi_empirical_types.mod multipole_types.mod atomic_kind_types.mod qmmm_types_low.mod input_constants.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod kinds.mod qmmm_util.mod semi_empirical_utils.mod message_passing.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_gpw_forces.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod cell_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_ks_qmmm_types.mod pw_pool_types.mod qmmm_gaussian_types.mod input_section_types.mod qmmm_types_low.mod qs_energy_types.mod input_constants.mod qmmm_se_forces.mod pw_methods.mod qmmm_tb_methods.mod cube_utils.mod kinds.mod qmmm_util.mod qmmm_gpw_energy.mod cp_output_handling.mod cp_spline_utils.mod message_passing.mod mm_collocate_potential.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F qmmm_gpw_forces.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:49:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gpw_forces.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gpw_forces.F90 -/build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F:484:36: + 237 | CALL virial_pair_force(atstr(:, :, jatom), -0.5_dp, fdij, rij) + | ^ +Warning: 'atstr.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:86:65: - 484 | tmp = rho%cr3d(lb(1), :, :) - | ^ -Warning: 'tmp.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F:484:36: Warning: 'tmp.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F:484:36: Warning: 'tmp.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F:484:36: + 86 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: atstr + | ^ +Warning: 'atstr.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:86:65: Warning: 'atstr.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:86:65: Warning: 'atstr.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:86:65: Warning: 'atstr.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:86:65: Warning: 'atstr.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:236:80: - 484 | tmp = rho%cr3d(lb(1), :, :) - | ^ -Warning: 'tmp.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_gpw_forces.mod' due to: qmmm_gpw_forces.o /build/reproducible-path/cp2k-8.1/src/qmmm_gpw_forces.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod cell_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_ks_qmmm_types.mod pw_pool_types.mod qmmm_gaussian_types.mod input_section_types.mod qmmm_types_low.mod qs_energy_types.mod input_constants.mod qmmm_se_forces.mod pw_methods.mod qmmm_tb_methods.mod cube_utils.mod kinds.mod qmmm_util.mod qmmm_gpw_energy.mod cp_output_handling.mod cp_spline_utils.mod message_passing.mod mm_collocate_potential.mod cp_log_handling.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xtb_ehess.o' due to: /build/reproducible-path/cp2k-8.1/src/xtb_ehess.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod atprop_types.mod distribution_1d_types.mod atomic_kind_types.mod ewald_pw_types.mod xtb_types.mod ewald_environment_types.mod mathconstants.mod kinds.mod ewald_methods_tb.mod message_passing.mod xtb_coulomb.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xtb_ehess.F xtb_ehess.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:49:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_ehess.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_ehess.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xtb_ehess.mod' due to: xtb_ehess.o /build/reproducible-path/cp2k-8.1/src/xtb_ehess.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod atprop_types.mod distribution_1d_types.mod atomic_kind_types.mod ewald_pw_types.mod xtb_types.mod ewald_environment_types.mod mathconstants.mod kinds.mod ewald_methods_tb.mod message_passing.mod xtb_coulomb.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod admm_types.mod pw_types.mod qs_p_env_types.mod qs_mo_types.mod qs_kind_types.mod xc_rho_set_types.mod lri_environment_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod qs_loc_types.mod xc_rho_cflags_types.mod kg_environment_types.mod pw_poisson_types.mod pw_pool_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod xtb_types.mod qs_kpp1_env_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod string_utilities.mod pw_methods.mod cp_gemm_interface.mod mulliken.mod qs_gapw_densities.mod cp_fm_struct.mod cp_files.mod qs_rho_methods.mod qs_vxc_atom.mod kinds.mod cp_fm_vect.mod pw_poisson_methods.mod hfx_energy_potential.mod preconditioner.mod cp_external_control.mod qs_integrate_potential.mod xtb_ehess.mod kg_correction.mod cp_output_handling.mod cp_dbcsr_operations.mod hartree_local_methods.mod cp_fm_basic_linalg.mod qs_loc_methods.mod message_passing.mod xc_derivatives.mod qs_collocate_density.mod qs_rho0_ggrid.mod lri_ks_methods.mod cp_log_handling.mod qs_ks_atom.mod base_hooks.mod qs_loc_utils.mod xc.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_methods.F qs_linres_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:49:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_methods.mod' due to: qs_linres_methods.o /build/reproducible-path/cp2k-8.1/src/qs_linres_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod admm_types.mod pw_types.mod qs_p_env_types.mod qs_mo_types.mod qs_kind_types.mod xc_rho_set_types.mod lri_environment_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod qs_loc_types.mod xc_rho_cflags_types.mod kg_environment_types.mod pw_poisson_types.mod pw_pool_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod xtb_types.mod qs_kpp1_env_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod string_utilities.mod pw_methods.mod cp_gemm_interface.mod mulliken.mod qs_gapw_densities.mod cp_fm_struct.mod cp_files.mod qs_rho_methods.mod qs_vxc_atom.mod kinds.mod cp_fm_vect.mod pw_poisson_methods.mod hfx_energy_potential.mod preconditioner.mod cp_external_control.mod qs_integrate_potential.mod xtb_ehess.mod kg_correction.mod cp_output_handling.mod cp_dbcsr_operations.mod hartree_local_methods.mod cp_fm_basic_linalg.mod qs_loc_methods.mod message_passing.mod xc_derivatives.mod qs_collocate_density.mod qs_rho0_ggrid.mod lri_ks_methods.mod cp_log_handling.mod qs_ks_atom.mod base_hooks.mod qs_loc_utils.mod xc.mod machine.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_kpp1_env_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_kpp1_env_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod qs_rho_types.mod pw_types.mod qs_p_env_types.mod xc_rho_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod pw_pool_types.mod input_section_types.mod qs_kpp1_env_types.mod qs_energy_types.mod input_constants.mod pw_methods.mod qs_ks_methods.mod qs_gapw_densities.mod qs_vxc_atom.mod kinds.mod kahan_sum.mod pw_poisson_methods.mod qs_integrate_potential.mod cp_output_handling.mod cp_dbcsr_operations.mod hartree_local_methods.mod xc_derivatives.mod qs_rho0_ggrid.mod cp_log_handling.mod qs_ks_atom.mod base_hooks.mod xc.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_kpp1_env_methods.F qs_kpp1_env_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:50:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_kpp1_env_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_kpp1_env_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_kpp1_env_methods.mod' due to: qs_kpp1_env_methods.o /build/reproducible-path/cp2k-8.1/src/qs_kpp1_env_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod qs_rho_types.mod pw_types.mod qs_p_env_types.mod xc_rho_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod pw_pool_types.mod input_section_types.mod qs_kpp1_env_types.mod qs_energy_types.mod input_constants.mod pw_methods.mod qs_ks_methods.mod qs_gapw_densities.mod qs_vxc_atom.mod kinds.mod kahan_sum.mod pw_poisson_methods.mod qs_integrate_potential.mod cp_output_handling.mod cp_dbcsr_operations.mod hartree_local_methods.mod xc_derivatives.mod qs_rho0_ggrid.mod cp_log_handling.mod qs_ks_atom.mod base_hooks.mod xc.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_p_env_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_p_env_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_rho_types.mod qs_p_env_types.mod hartree_local_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_linres_types.mod qs_local_rho_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod preconditioner_types.mod qs_kpp1_env_types.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod qs_rho_atom_methods.mod string_utilities.mod cp_gemm_interface.mod qs_ks_methods.mod cp_fm_struct.mod cp_blacs_env.mod qs_matrix_pools.mod qs_rho_methods.mod kinds.mod cp_fm_vect.mod qs_kpp1_env_methods.mod cp_output_handling.mod cp_dbcsr_operations.mod hartree_local_methods.mod cp_fm_basic_linalg.mod qs_rho0_methods.mod cp_fm_cholesky.mod qs_rho0_ggrid.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_p_env_methods.F qs_p_env_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:50:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_p_env_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_p_env_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_p_env_methods.mod' due to: qs_p_env_methods.o /build/reproducible-path/cp2k-8.1/src/qs_p_env_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_rho_types.mod qs_p_env_types.mod hartree_local_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_linres_types.mod qs_local_rho_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod preconditioner_types.mod qs_kpp1_env_types.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod qs_rho_atom_methods.mod string_utilities.mod cp_gemm_interface.mod qs_ks_methods.mod cp_fm_struct.mod cp_blacs_env.mod qs_matrix_pools.mod qs_rho_methods.mod kinds.mod cp_fm_vect.mod qs_kpp1_env_methods.mod cp_output_handling.mod cp_dbcsr_operations.mod hartree_local_methods.mod cp_fm_basic_linalg.mod qs_rho0_methods.mod cp_fm_cholesky.mod qs_rho0_ggrid.mod cp_log_handling.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'response_solver.o' due to: /build/reproducible-path/cp2k-8.1/src/response_solver.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod admm_types.mod qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod qs_p_env_types.mod qs_mo_types.mod qs_kind_types.mod xc_rho_set_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod xc_rho_cflags_types.mod kg_environment_types.mod pw_poisson_types.mod pw_pool_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod pw_grid_types.mod input_constants.mod pw_methods.mod qs_ks_methods.mod cp_gemm_interface.mod hfx_derivatives.mod qs_core_energies.mod qs_linres_methods.mod cp_fm_struct.mod qs_vxc.mod cp_blacs_env.mod kg_tnadd_mat.mod kinds.mod pw_poisson_methods.mod hfx_energy_potential.mod qs_integrate_potential.mod kg_correction.mod cp_dbcsr_operations.mod qs_p_env_methods.mod core_ppl.mod message_passing.mod xc_derivatives.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod core_ppnl.mod qs_overlap.mod cp_log_handling.mod base_hooks.mod xc.mod qs_kinetic.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/response_solver.F response_solver.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:50:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"response_solver.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' response_solver.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'response_solver.mod' due to: response_solver.o /build/reproducible-path/cp2k-8.1/src/response_solver.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod admm_types.mod qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod qs_p_env_types.mod qs_mo_types.mod qs_kind_types.mod xc_rho_set_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod xc_rho_cflags_types.mod kg_environment_types.mod pw_poisson_types.mod pw_pool_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod pw_grid_types.mod input_constants.mod pw_methods.mod qs_ks_methods.mod cp_gemm_interface.mod hfx_derivatives.mod qs_core_energies.mod qs_linres_methods.mod cp_fm_struct.mod qs_vxc.mod cp_blacs_env.mod kg_tnadd_mat.mod kinds.mod pw_poisson_methods.mod hfx_energy_potential.mod qs_integrate_potential.mod kg_correction.mod cp_dbcsr_operations.mod qs_p_env_methods.mod core_ppl.mod message_passing.mod xc_derivatives.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod core_ppnl.mod qs_overlap.mod cp_log_handling.mod base_hooks.mod xc.mod qs_kinetic.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ec_efield_local.o' due to: /build/reproducible-path/cp2k-8.1/src/ec_efield_local.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_period_efield_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod ec_env_types.mod atomic_kind_types.mod qs_force_types.mod qs_energy_types.mod ai_moments.mod kinds.mod base_hooks.mod qs_moments.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ec_efield_local.F ec_efield_local.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:50:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ec_efield_local.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ec_efield_local.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ec_efield_local.mod' due to: ec_efield_local.o /build/reproducible-path/cp2k-8.1/src/ec_efield_local.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_period_efield_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod ec_env_types.mod atomic_kind_types.mod qs_force_types.mod qs_energy_types.mod ai_moments.mod kinds.mod base_hooks.mod qs_moments.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mao_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/mao_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod basis_set_container_types.mod cp_fm_types.mod atomic_kind_types.mod input_constants.mod lapack.mod cp_fm_diag.mod cp_fm_struct.mod kinds.mod kpoint_methods.mod qs_interactions.mod cp_dbcsr_operations.mod message_passing.mod iterate_matrix.mod cp_dbcsr_cp2k_link.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mao_methods.F mao_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:50:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mao_methods.mod' due to: mao_methods.o /build/reproducible-path/cp2k-8.1/src/mao_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod basis_set_container_types.mod cp_fm_types.mod atomic_kind_types.mod input_constants.mod lapack.mod cp_fm_diag.mod cp_fm_struct.mod kinds.mod kpoint_methods.mod qs_interactions.mod cp_dbcsr_operations.mod message_passing.mod iterate_matrix.mod cp_dbcsr_cp2k_link.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mao_optimizer.o' due to: /build/reproducible-path/cp2k-8.1/src/mao_optimizer.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_dbcsr_operations.mod kinds.mod mao_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mao_optimizer.F mao_optimizer.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:50:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_optimizer.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_optimizer.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mao_optimizer.mod' due to: mao_optimizer.o /build/reproducible-path/cp2k-8.1/src/mao_optimizer.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod cp_dbcsr_operations.mod kinds.mod mao_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mao_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/mao_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_rho_types.mod qs_kind_types.mod particle_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cp_control_types.mod qs_ks_types.mod base_hooks.mod qs_neighbor_lists.mod cp_dbcsr_operations.mod mao_optimizer.mod qs_overlap.mod kinds.mod particle_methods.mod mao_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mao_basis.F mao_basis.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:50:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_basis.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mao_basis.mod' due to: mao_basis.o /build/reproducible-path/cp2k-8.1/src/mao_basis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_rho_types.mod qs_kind_types.mod particle_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cp_control_types.mod qs_ks_types.mod base_hooks.mod qs_neighbor_lists.mod cp_dbcsr_operations.mod mao_optimizer.mod qs_overlap.mod kinds.mod particle_methods.mod mao_methods.mod + 236 | CALL virial_pair_force(atstr(:, :, iatom), -0.5_dp, fdij, rij) + | ^ +Warning: 'atstr.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_gcp_method.mod' due to: qs_gcp_method.o /build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod atprop_types.mod qs_environment_types.mod qs_neighbor_list_types.mod virial_types.mod qs_kind_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_gcp_types.mod atomic_kind_types.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod physcon.mod ai_overlap.mod virial_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'energy_corrections.o' due to: /build/reproducible-path/cp2k-8.1/src/energy_corrections.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod distribution_2d_types.mod xc_rho_set_types.mod basis_set_types.mod xc_rho_cflags_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod external_potential_types.mod distribution_1d_types.mod cp_fm_types.mod ec_env_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod task_list_types.mod qs_ks_types.mod molecule_types.mod qs_energy_types.mod input_constants.mod task_list_methods.mod pw_methods.mod qs_ks_methods.mod cp_fm_diag.mod qs_core_energies.mod cp_fm_struct.mod qs_vxc.mod cp_blacs_env.mod kinds.mod pw_poisson_methods.mod qs_integrate_potential.mod dm_ls_scf_methods.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod core_ppl.mod physcon.mod response_solver.mod moments_utils.mod message_passing.mod qs_dispersion_pairpot.mod ec_efield_local.mod xc_derivatives.mod iterate_matrix.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod cp_fm_cholesky.mod core_ppnl.mod qs_overlap.mod cp_log_handling.mod base_hooks.mod mao_basis.mod qs_neighbor_lists.mod xc.mod qs_moments.mod qs_kinetic.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/energy_corrections.F energy_corrections.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:50:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"energy_corrections.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' energy_corrections.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'energy_corrections.mod' due to: energy_corrections.o /build/reproducible-path/cp2k-8.1/src/energy_corrections.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod distribution_2d_types.mod xc_rho_set_types.mod basis_set_types.mod xc_rho_cflags_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod external_potential_types.mod distribution_1d_types.mod cp_fm_types.mod ec_env_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod task_list_types.mod qs_ks_types.mod molecule_types.mod qs_energy_types.mod input_constants.mod task_list_methods.mod pw_methods.mod qs_ks_methods.mod cp_fm_diag.mod qs_core_energies.mod cp_fm_struct.mod qs_vxc.mod cp_blacs_env.mod kinds.mod pw_poisson_methods.mod qs_integrate_potential.mod dm_ls_scf_methods.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod core_ppl.mod physcon.mod response_solver.mod moments_utils.mod message_passing.mod qs_dispersion_pairpot.mod ec_efield_local.mod xc_derivatives.mod iterate_matrix.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod cp_fm_cholesky.mod core_ppnl.mod qs_overlap.mod cp_log_handling.mod base_hooks.mod mao_basis.mod qs_neighbor_lists.mod xc.mod qs_moments.mod qs_kinetic.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb_dispersion.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb_dispersion.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod qs_force_types.mod atprop_types.mod qs_dispersion_types.mod qs_dftb_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod qs_dftb_utils.mod virial_methods.mod message_passing.mod qs_dispersion_pairpot.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dftb_dispersion.F qs_dftb_dispersion.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:59:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_dispersion.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_dispersion.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb_dispersion.mod' due to: qs_dftb_dispersion.o /build/reproducible-path/cp2k-8.1/src/qs_dftb_dispersion.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod qs_force_types.mod atprop_types.mod qs_dispersion_types.mod qs_dftb_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod qs_dftb_utils.mod virial_methods.mod message_passing.mod qs_dispersion_pairpot.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_distribution_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_distribution_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_atomic_halo_types.mod qs_fb_env_types.mod cp_para_types.mod input_section_types.mod qs_kind_types.mod qs_environment_types.mod cell_types.mod particle_types.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod util.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_distribution_methods.F qs_fb_distribution_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:51:19 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_distribution_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_distribution_methods.F90 -/build/reproducible-path/cp2k-8.1/src/qs_fb_distribution_methods.F:766:37: - - 766 | SUBROUTINE fb_distribution_move_el(dist_from, element, dist_to) - | ^ -Warning: 'fb_distribution_move_el' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_distribution_methods.mod' due to: qs_fb_distribution_methods.o /build/reproducible-path/cp2k-8.1/src/qs_fb_distribution_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_atomic_halo_types.mod qs_fb_env_types.mod cp_para_types.mod input_section_types.mod qs_kind_types.mod qs_environment_types.mod cell_types.mod particle_types.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_energy_init.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_energy_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod molecule_types.mod qs_dispersion_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_gcp_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod kg_environment_types.mod lri_environment_types.mod kinds.mod xtb_matrices.mod se_core_matrix.mod qs_dftb_matrices.mod cp_dbcsr_operations.mod qs_external_density.mod qs_neighbor_lists.mod kg_environment.mod qs_update_s_mstruct.mod qs_ks_methods.mod qs_core_energies.mod qs_core_hamiltonian.mod qs_external_potential.mod se_core_core.mod qs_dispersion_pairpot.mod lri_environment_methods.mod optimize_embedding_potential.mod base_hooks.mod efield_utils.mod qs_gcp_method.mod input_constants.mod kpoint_methods.mod ri_environment_methods.mod qs_dftb_dispersion.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_energy_init.F qs_energy_init.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:59:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_init.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_energy_init.mod' due to: qs_energy_init.o /build/reproducible-path/cp2k-8.1/src/qs_energy_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod molecule_types.mod qs_dispersion_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_gcp_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod kg_environment_types.mod lri_environment_types.mod kinds.mod xtb_matrices.mod se_core_matrix.mod qs_dftb_matrices.mod cp_dbcsr_operations.mod qs_external_density.mod qs_neighbor_lists.mod kg_environment.mod qs_update_s_mstruct.mod qs_ks_methods.mod qs_core_energies.mod qs_core_hamiltonian.mod qs_external_potential.mod se_core_core.mod qs_dispersion_pairpot.mod lri_environment_methods.mod optimize_embedding_potential.mod base_hooks.mod efield_utils.mod qs_gcp_method.mod input_constants.mod kpoint_methods.mod ri_environment_methods.mod qs_dftb_dispersion.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_buffer_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_buffer_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_buffer_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_buffer_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_buffer_types.F qs_fb_buffer_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:51:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_buffer_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_buffer_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 15:59:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_buffer_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_buffer_types.F90 /build/reproducible-path/cp2k-8.1/src/qs_fb_buffer_types.F:206:35: 206 | SUBROUTINE fb_buffer_i_associate(a, b) @@ -44924,11 +44704,11 @@ 524 | SUBROUTINE fb_buffer_d_associate(a, b) | ^ Warning: 'fb_buffer_d_associate' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_buffer_types.mod' due to: qs_fb_buffer_types.o /build/reproducible-path/cp2k-8.1/src/qs_fb_buffer_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_buffer_types.mod' due to: qs_fb_buffer_types.o /build/reproducible-path/cp2k-8.1/src/qs_fb_buffer_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_hash_table_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_hash_table_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_hash_table_functions.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_hash_table_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_hash_table_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_hash_table_functions.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_hash_table_types.F qs_fb_hash_table_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:51:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_hash_table_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_hash_table_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_hash_table_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_hash_table_types.F90 /build/reproducible-path/cp2k-8.1/src/qs_fb_hash_table_types.F:339:34: 339 | SUBROUTINE fb_hash_table_remove(hash_table, key) @@ -44944,11 +44724,11 @@ 392 | SUBROUTINE fb_hash_table_status(hash_table, nelements, nmax, prime) | ^ Warning: 'fb_hash_table_status' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_hash_table_types.mod' due to: qs_fb_hash_table_types.o /build/reproducible-path/cp2k-8.1/src/qs_fb_hash_table_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_hash_table_functions.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_hash_table_types.mod' due to: qs_fb_hash_table_types.o /build/reproducible-path/cp2k-8.1/src/qs_fb_hash_table_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_hash_table_functions.mod base_hooks.mod kinds.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_matrix_data_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_matrix_data_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_buffer_types.mod qs_fb_hash_table_types.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_matrix_data_types.F qs_fb_matrix_data_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:51:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_matrix_data_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_matrix_data_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_matrix_data_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_matrix_data_types.F90 /build/reproducible-path/cp2k-8.1/src/qs_fb_matrix_data_types.F:141:38: 141 | SUBROUTINE fb_matrix_data_associate(a, b) @@ -44966,9 +44746,9 @@ Warning: 'fb_matrix_data_status' defined but not used [-Wunused-function] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_matrix_data_types.mod' due to: qs_fb_matrix_data_types.o /build/reproducible-path/cp2k-8.1/src/qs_fb_matrix_data_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_buffer_types.mod qs_fb_hash_table_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_com_tasks_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_com_tasks_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_fb_matrix_data_types.mod base_hooks.mod message_passing.mod util.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_com_tasks_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_com_tasks_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_fb_matrix_data_types.mod message_passing.mod util.mod kinds.mod base_hooks.mod memory_utilities.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_com_tasks_types.F qs_fb_com_tasks_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:51:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_com_tasks_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_com_tasks_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_com_tasks_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_com_tasks_types.F90 /build/reproducible-path/cp2k-8.1/src/qs_fb_com_tasks_types.F:159:33: 159 | SUBROUTINE fb_com_tasks_retain(com_tasks) @@ -44999,363 +44779,143 @@ 360 | SUBROUTINE fb_com_tasks_init(com_tasks) | ^ Warning: 'fb_com_tasks_init' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_com_tasks_types.mod' due to: qs_fb_com_tasks_types.o /build/reproducible-path/cp2k-8.1/src/qs_fb_com_tasks_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_fb_matrix_data_types.mod base_hooks.mod message_passing.mod util.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_com_tasks_types.mod' due to: qs_fb_com_tasks_types.o /build/reproducible-path/cp2k-8.1/src/qs_fb_com_tasks_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_fb_matrix_data_types.mod message_passing.mod util.mod kinds.mod base_hooks.mod memory_utilities.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_atomic_matrix_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_atomic_matrix_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_atomic_halo_types.mod qs_fb_com_tasks_types.mod cp_para_types.mod qs_fb_matrix_data_types.mod base_hooks.mod message_passing.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_atomic_matrix_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_atomic_matrix_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_com_tasks_types.mod cp_para_types.mod qs_fb_atomic_halo_types.mod qs_fb_matrix_data_types.mod message_passing.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_atomic_matrix_methods.F qs_fb_atomic_matrix_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:51:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_atomic_matrix_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_atomic_matrix_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_atomic_matrix_methods.mod' due to: qs_fb_atomic_matrix_methods.o /build/reproducible-path/cp2k-8.1/src/qs_fb_atomic_matrix_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_atomic_halo_types.mod qs_fb_com_tasks_types.mod cp_para_types.mod qs_fb_matrix_data_types.mod base_hooks.mod message_passing.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_atomic_matrix_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_atomic_matrix_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_atomic_matrix_methods.mod' due to: qs_fb_atomic_matrix_methods.o /build/reproducible-path/cp2k-8.1/src/qs_fb_atomic_matrix_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_com_tasks_types.mod cp_para_types.mod qs_fb_atomic_halo_types.mod qs_fb_matrix_data_types.mod message_passing.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_filter_matrix_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_filter_matrix_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_atomic_halo_types.mod qs_fb_com_tasks_types.mod atomic_kind_types.mod cp_para_types.mod qs_fb_matrix_data_types.mod particle_types.mod qs_fb_trial_fns_types.mod string_utilities.mod message_passing.mod base_hooks.mod fermi_utils.mod qs_fb_atomic_matrix_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_filter_matrix_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_filter_matrix_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_com_tasks_types.mod cp_para_types.mod qs_fb_trial_fns_types.mod qs_fb_atomic_halo_types.mod atomic_kind_types.mod particle_types.mod qs_fb_matrix_data_types.mod message_passing.mod kinds.mod base_hooks.mod fermi_utils.mod string_utilities.mod qs_fb_atomic_matrix_methods.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_filter_matrix_methods.F qs_fb_filter_matrix_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:51:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_filter_matrix_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_filter_matrix_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_filter_matrix_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_filter_matrix_methods.F90 /build/reproducible-path/cp2k-8.1/src/qs_fb_filter_matrix_methods.F:1434:39: 1434 | SUBROUTINE fb_fltrmat_fermi_dirac_ne(f, eigenvals, T, ne, maxocc) | ^ Warning: 'fb_fltrmat_fermi_dirac_ne' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_filter_matrix_methods.mod' due to: qs_fb_filter_matrix_methods.o /build/reproducible-path/cp2k-8.1/src/qs_fb_filter_matrix_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_atomic_halo_types.mod qs_fb_com_tasks_types.mod atomic_kind_types.mod cp_para_types.mod qs_fb_matrix_data_types.mod particle_types.mod qs_fb_trial_fns_types.mod string_utilities.mod message_passing.mod base_hooks.mod fermi_utils.mod qs_fb_atomic_matrix_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_filter_matrix_methods.mod' due to: qs_fb_filter_matrix_methods.o /build/reproducible-path/cp2k-8.1/src/qs_fb_filter_matrix_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_fb_com_tasks_types.mod cp_para_types.mod qs_fb_trial_fns_types.mod qs_fb_atomic_halo_types.mod atomic_kind_types.mod particle_types.mod qs_fb_matrix_data_types.mod message_passing.mod kinds.mod base_hooks.mod fermi_utils.mod string_utilities.mod qs_fb_atomic_matrix_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_env_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_env_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_mo_types.mod qs_kind_types.mod qs_fb_atomic_halo_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_fb_trial_fns_types.mod qs_fb_env_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod input_constants.mod string_utilities.mod qs_fb_filter_matrix_methods.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_integral_utils.mod message_passing.mod cp_fm_cholesky.mod qs_diis.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod qs_mo_methods.mod orbital_pointers.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_env_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_env_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_mo_types.mod qs_scf_types.mod qs_fb_env_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod qs_fb_trial_fns_types.mod qs_fb_atomic_halo_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod qs_mo_occupation.mod cp_dbcsr_operations.mod message_passing.mod qs_matrix_pools.mod qs_mo_methods.mod qs_fb_filter_matrix_methods.mod qs_integral_utils.mod cp_fm_cholesky.mod string_utilities.mod cp_fm_basic_linalg.mod orbital_pointers.mod qs_diis.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod input_constants.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_env_methods.F qs_fb_env_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:51:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_env_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_env_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_env_methods.mod' due to: qs_fb_env_methods.o /build/reproducible-path/cp2k-8.1/src/qs_fb_env_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_mo_types.mod qs_kind_types.mod qs_fb_atomic_halo_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_fb_trial_fns_types.mod qs_fb_env_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod input_constants.mod string_utilities.mod qs_fb_filter_matrix_methods.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_integral_utils.mod message_passing.mod cp_fm_cholesky.mod qs_diis.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod qs_mo_methods.mod orbital_pointers.mod cp_units.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_env_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_env_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_env_methods.mod' due to: qs_fb_env_methods.o /build/reproducible-path/cp2k-8.1/src/qs_fb_env_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_mo_types.mod qs_scf_types.mod qs_fb_env_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod qs_fb_trial_fns_types.mod qs_fb_atomic_halo_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod qs_mo_occupation.mod cp_dbcsr_operations.mod message_passing.mod qs_matrix_pools.mod qs_mo_methods.mod qs_fb_filter_matrix_methods.mod qs_integral_utils.mod cp_fm_cholesky.mod string_utilities.mod cp_fm_basic_linalg.mod orbital_pointers.mod qs_diis.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_restart.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_restart.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod xas_env_types.mod qs_scf_types.mod cp_fm_types.mod scf_control_types.mod input_section_types.mod qs_ks_types.mod qs_mixing_utils.mod string_utilities.mod cp_gemm_interface.mod cp_files.mod qs_rho_methods.mod qs_mo_io.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod message_passing.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod qs_mo_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_restart.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_restart.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod scf_control_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod xas_env_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod qs_rho_atom_types.mod cp_log_handling.mod kinds.mod qs_mixing_utils.mod cp_gemm_interface.mod cp_output_handling.mod qs_rho_methods.mod qs_mo_occupation.mod cp_dbcsr_operations.mod message_passing.mod qs_mo_methods.mod string_utilities.mod cp_files.mod base_hooks.mod qs_mo_io.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_restart.F xas_restart.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:51:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_restart.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_restart.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_restart.mod' due to: xas_restart.o /build/reproducible-path/cp2k-8.1/src/xas_restart.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod xas_env_types.mod qs_scf_types.mod cp_fm_types.mod scf_control_types.mod input_section_types.mod qs_ks_types.mod qs_mixing_utils.mod string_utilities.mod cp_gemm_interface.mod cp_files.mod qs_rho_methods.mod qs_mo_io.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod message_passing.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod qs_mo_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_initialization.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_initialization.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_rho_types.mod pw_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod qs_cdft_opt_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod xas_env_types.mod qs_fb_env_types.mod qs_scf_types.mod qs_density_mixing_types.mod cp_fm_types.mod scf_control_types.mod input_section_types.mod qs_block_davidson_types.mod qs_ks_types.mod qs_fb_distribution_methods.mod input_constants.mod qs_fb_env_methods.mod qs_mixing_utils.mod cp_fm_diag.mod cp_fm_struct.mod qs_matrix_pools.mod qs_rho_methods.mod kinds.mod qs_scf_lanczos.mod qs_scf_output.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_outer_scf.mod xas_restart.mod qs_wf_history_methods.mod cp_fm_cholesky.mod qs_scf_diagonalization.mod cp_log_handling.mod qs_mo_occupation.mod cp_dbcsr_output.mod base_hooks.mod qs_initial_guess.mod qmmm_image_charge.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_initialization.F qs_scf_initialization.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:52:00 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_initialization.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_initialization.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_initialization.mod' due to: qs_scf_initialization.o /build/reproducible-path/cp2k-8.1/src/qs_scf_initialization.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_rho_types.mod pw_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod qs_cdft_opt_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod xas_env_types.mod qs_fb_env_types.mod qs_scf_types.mod qs_density_mixing_types.mod cp_fm_types.mod scf_control_types.mod input_section_types.mod qs_block_davidson_types.mod qs_ks_types.mod qs_fb_distribution_methods.mod input_constants.mod qs_fb_env_methods.mod qs_mixing_utils.mod cp_fm_diag.mod cp_fm_struct.mod qs_matrix_pools.mod qs_rho_methods.mod kinds.mod qs_scf_lanczos.mod qs_scf_output.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_outer_scf.mod xas_restart.mod qs_wf_history_methods.mod cp_fm_cholesky.mod qs_scf_diagonalization.mod cp_log_handling.mod qs_mo_occupation.mod cp_dbcsr_output.mod base_hooks.mod qs_initial_guess.mod qmmm_image_charge.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ot_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ot_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod qs_mo_types.mod input_section_types.mod qs_ot_types.mod cp_fm_types.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod cp_output_handling.mod qs_ot.mod cp_array_utils.mod cp_dbcsr_operations.mod qs_ot_minimizer.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ot_scf.F qs_ot_scf.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:52:16 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot_scf.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ot_scf.mod' due to: qs_ot_scf.o /build/reproducible-path/cp2k-8.1/src/qs_ot_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod qs_mo_types.mod input_section_types.mod qs_ot_types.mod cp_fm_types.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod cp_output_handling.mod qs_ot.mod cp_array_utils.mod cp_dbcsr_operations.mod qs_ot_minimizer.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_loop_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_loop_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod kpoint_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_scf_types.mod qs_density_mixing_types.mod scf_control_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod qs_fb_env_methods.mod qs_mixing_utils.mod qs_mom_methods.mod qs_rho_methods.mod kinds.mod qs_scf_output.mod cp_external_control.mod qs_outer_scf.mod qs_scf_methods.mod qs_scf_diagonalization.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod qs_ot_scf.mod qs_mo_methods.mod qs_gspace_mixing.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_loop_utils.F qs_scf_loop_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:52:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_loop_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_loop_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_loop_utils.mod' due to: qs_scf_loop_utils.o /build/reproducible-path/cp2k-8.1/src/qs_scf_loop_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod kpoint_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_scf_types.mod qs_density_mixing_types.mod scf_control_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod qs_fb_env_methods.mod qs_mixing_utils.mod qs_mom_methods.mod qs_rho_methods.mod kinds.mod qs_scf_output.mod cp_external_control.mod qs_outer_scf.mod qs_scf_methods.mod qs_scf_diagonalization.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod qs_ot_scf.mod qs_mo_methods.mod qs_gspace_mixing.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_restart.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_restart.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_restart.mod' due to: xas_restart.o /build/reproducible-path/cp2k-8.1/src/xas_restart.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod scf_control_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod xas_env_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod qs_rho_atom_types.mod cp_log_handling.mod kinds.mod qs_mixing_utils.mod cp_gemm_interface.mod cp_output_handling.mod qs_rho_methods.mod qs_mo_occupation.mod cp_dbcsr_operations.mod message_passing.mod qs_mo_methods.mod string_utilities.mod cp_files.mod base_hooks.mod qs_mo_io.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_cdft_scf_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_cdft_scf_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod cp_para_types.mod qs_scf_types.mod qs_environment_types.mod cp_control_types.mod input_constants.mod mathlib.mod cp_log_handling.mod cp_files.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_cdft_scf_utils.F qs_cdft_scf_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:52:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_scf_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_scf_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_cdft_scf_utils.mod' due to: qs_cdft_scf_utils.o /build/reproducible-path/cp2k-8.1/src/qs_cdft_scf_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod cp_para_types.mod qs_scf_types.mod qs_environment_types.mod cp_control_types.mod input_constants.mod mathlib.mod cp_log_handling.mod cp_files.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecular_moments.o' due to: /build/reproducible-path/cp2k-8.1/src/molecular_moments.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod molecule_kind_types.mod qs_loc_types.mod distribution_1d_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod input_constants.mod cp_fm_struct.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod moments_utils.mod message_passing.mod cp_log_handling.mod base_hooks.mod qs_moments.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/molecular_moments.F molecular_moments.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:52:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molecular_moments.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecular_moments.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molecular_moments.mod' due to: molecular_moments.o /build/reproducible-path/cp2k-8.1/src/molecular_moments.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod molecule_kind_types.mod qs_loc_types.mod distribution_1d_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod input_constants.mod cp_fm_struct.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod moments_utils.mod message_passing.mod cp_log_handling.mod base_hooks.mod qs_moments.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'wannier_states.o' due to: /build/reproducible-path/cp2k-8.1/src/wannier_states.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 wannier_states_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod cp_fm_types.mod cp_log_handling.mod base_hooks.mod cp_gemm_interface.mod cp_fm_struct.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/wannier_states.F wannier_states.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:52:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"wannier_states.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' wannier_states.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'wannier_states.mod' due to: wannier_states.o /build/reproducible-path/cp2k-8.1/src/wannier_states.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 wannier_states_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod cp_fm_types.mod cp_log_handling.mod base_hooks.mod cp_gemm_interface.mod cp_fm_struct.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_units.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecular_dipoles.o' due to: /build/reproducible-path/cp2k-8.1/src/molecular_dipoles.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod molecule_kind_types.mod qs_loc_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod mathconstants.mod kinds.mod cp_output_handling.mod physcon.mod moments_utils.mod message_passing.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/molecular_dipoles.F molecular_dipoles.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:52:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molecular_dipoles.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecular_dipoles.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molecular_dipoles.mod' due to: molecular_dipoles.o /build/reproducible-path/cp2k-8.1/src/molecular_dipoles.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod molecule_kind_types.mod qs_loc_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod mathconstants.mod kinds.mod cp_output_handling.mod physcon.mod moments_utils.mod message_passing.mod cp_log_handling.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_loc_molecules.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_loc_molecules.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod qs_loc_types.mod cp_para_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_loc_molecules.F qs_loc_molecules.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:53:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_molecules.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_molecules.F90 -/build/reproducible-path/cp2k-8.1/src/qs_loc_molecules.F:172:60: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_fb_distribution_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_fb_distribution_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_fb_atomic_halo_types.mod qs_fb_env_types.mod qs_kind_types.mod particle_types.mod cell_types.mod input_section_types.mod util.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_fb_distribution_methods.F qs_fb_distribution_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_fb_distribution_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_fb_distribution_methods.F90 +/build/reproducible-path/cp2k-8.1/src/qs_fb_distribution_methods.F:766:37: - 172 | i = molecule_set(imol_now)%lmi(ispin)%nstates - | ^ -Warning: 'imol_now' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_loc_molecules.mod' due to: qs_loc_molecules.o /build/reproducible-path/cp2k-8.1/src/qs_loc_molecules.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod qs_loc_types.mod cp_para_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod kinds.mod memory_utilities.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecular_states.o' due to: /build/reproducible-path/cp2k-8.1/src/molecular_states.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod message_passing.mod qs_collocate_density.mod bibliography.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/molecular_states.F molecular_states.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:53:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molecular_states.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecular_states.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molecular_states.mod' due to: molecular_states.o /build/reproducible-path/cp2k-8.1/src/molecular_states.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod message_passing.mod qs_collocate_density.mod bibliography.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_loc_states.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_loc_states.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_mo_types.mod wannier_states_types.mod qs_environment_types.mod cp_control_types.mod qs_loc_types.mod particle_list_types.mod cp_fm_types.mod input_section_types.mod molecule_types.mod molecular_moments.mod kinds.mod cp_output_handling.mod cp_array_utils.mod qs_loc_methods.mod wannier_states.mod molecular_dipoles.mod cp_log_handling.mod base_hooks.mod qs_loc_molecules.mod molecular_states.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_loc_states.F qs_loc_states.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:53:10 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_states.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_states.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_loc_states.mod' due to: qs_loc_states.o /build/reproducible-path/cp2k-8.1/src/qs_loc_states.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_mo_types.mod wannier_states_types.mod qs_environment_types.mod cp_control_types.mod qs_loc_types.mod particle_list_types.mod cp_fm_types.mod input_section_types.mod molecule_types.mod molecular_moments.mod kinds.mod cp_output_handling.mod cp_array_utils.mod qs_loc_methods.mod wannier_states.mod molecular_dipoles.mod cp_log_handling.mod base_hooks.mod qs_loc_molecules.mod molecular_states.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_loc_dipole.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_loc_dipole.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_loc_types.mod atomic_kind_types.mod cp_control_types.mod cp_result_types.mod input_section_types.mod qs_kind_types.mod qs_environment_types.mod cell_types.mod particle_types.mod cp_log_handling.mod mathconstants.mod moments_utils.mod base_hooks.mod cp_output_handling.mod physcon.mod cp_result_methods.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_loc_dipole.F qs_loc_dipole.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:53:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_dipole.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_dipole.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_loc_dipole.mod' due to: qs_loc_dipole.o /build/reproducible-path/cp2k-8.1/src/qs_loc_dipole.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_loc_types.mod atomic_kind_types.mod cp_control_types.mod cp_result_types.mod input_section_types.mod qs_kind_types.mod qs_environment_types.mod cell_types.mod particle_types.mod cp_log_handling.mod mathconstants.mod moments_utils.mod base_hooks.mod cp_output_handling.mod physcon.mod cp_result_methods.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'localization_tb.o' due to: /build/reproducible-path/cp2k-8.1/src/localization_tb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_subsys_types.mod qs_mo_types.mod qs_kind_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_loc_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_loc_states.mod kinds.mod cp_fm_vect.mod cp_array_utils.mod qs_loc_dipole.mod cp_log_handling.mod base_hooks.mod qs_loc_utils.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/localization_tb.F localization_tb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:53:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"localization_tb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' localization_tb.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'localization_tb.mod' due to: localization_tb.o /build/reproducible-path/cp2k-8.1/src/localization_tb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_subsys_types.mod qs_mo_types.mod qs_kind_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_loc_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_loc_states.mod kinds.mod cp_fm_vect.mod cp_array_utils.mod qs_loc_dipole.mod cp_log_handling.mod base_hooks.mod qs_loc_utils.mod + 766 | SUBROUTINE fb_distribution_move_el(dist_from, element, dist_to) + | ^ +Warning: 'fb_distribution_move_el' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_fb_distribution_methods.mod' due to: qs_fb_distribution_methods.o /build/reproducible-path/cp2k-8.1/src/qs_fb_distribution_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_fb_atomic_halo_types.mod qs_fb_env_types.mod qs_kind_types.mod particle_types.mod cell_types.mod input_section_types.mod util.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'basis_set_output.o' due to: /build/reproducible-path/cp2k-8.1/src/basis_set_output.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod input_section_types.mod qs_kind_types.mod qs_environment_types.mod cp_log_handling.mod base_hooks.mod cp2k_info.mod cp_files.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/basis_set_output.F basis_set_output.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:53:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"basis_set_output.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' basis_set_output.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'basis_set_output.mod' due to: basis_set_output.o /build/reproducible-path/cp2k-8.1/src/basis_set_output.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod input_section_types.mod qs_kind_types.mod qs_environment_types.mod cp_log_handling.mod base_hooks.mod cp2k_info.mod cp_files.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_initialization.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_initialization.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod scf_control_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod xas_env_types.mod qs_fb_env_types.mod cp_fm_types.mod qs_environment_types.mod qs_block_davidson_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_density_mixing_types.mod cp_control_types.mod qs_cdft_opt_types.mod qs_rho_atom_types.mod cp_log_handling.mod qs_fb_env_methods.mod kinds.mod qs_mixing_utils.mod cp_output_handling.mod qs_wf_history_methods.mod qs_rho_methods.mod cp_fm_struct.mod qs_mo_occupation.mod cp_dbcsr_operations.mod qs_matrix_pools.mod qmmm_image_charge.mod qs_initial_guess.mod cp_dbcsr_output.mod cp_fm_cholesky.mod xas_restart.mod qs_scf_lanczos.mod cp_fm_basic_linalg.mod qs_fb_distribution_methods.mod qs_scf_output.mod base_hooks.mod cp_fm_diag.mod qs_scf_diagonalization.mod input_constants.mod qs_outer_scf.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_initialization.F qs_scf_initialization.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:24 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_initialization.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_initialization.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_initialization.mod' due to: qs_scf_initialization.o /build/reproducible-path/cp2k-8.1/src/qs_scf_initialization.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod scf_control_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod xas_env_types.mod qs_fb_env_types.mod cp_fm_types.mod qs_environment_types.mod qs_block_davidson_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_density_mixing_types.mod cp_control_types.mod qs_cdft_opt_types.mod qs_rho_atom_types.mod cp_log_handling.mod qs_fb_env_methods.mod kinds.mod qs_mixing_utils.mod cp_output_handling.mod qs_wf_history_methods.mod qs_rho_methods.mod cp_fm_struct.mod qs_mo_occupation.mod cp_dbcsr_operations.mod qs_matrix_pools.mod qmmm_image_charge.mod qs_initial_guess.mod cp_dbcsr_output.mod cp_fm_cholesky.mod xas_restart.mod qs_scf_lanczos.mod cp_fm_basic_linalg.mod qs_fb_distribution_methods.mod qs_scf_output.mod base_hooks.mod cp_fm_diag.mod qs_scf_diagonalization.mod input_constants.mod qs_outer_scf.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_optimize_ri_basis_types.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_optimize_ri_basis_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod mathconstants.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_optimize_ri_basis_types.F lri_optimize_ri_basis_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:53:32 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_optimize_ri_basis_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_optimize_ri_basis_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_optimize_ri_basis_types.mod' due to: lri_optimize_ri_basis_types.o /build/reproducible-path/cp2k-8.1/src/lri_optimize_ri_basis_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod mathconstants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_gamma2kp.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_gamma2kp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_scf_types.mod cp_subsys_types.mod kpoint_types.mod input_section_types.mod qs_environment.mod kinds.mod qs_energy_init.mod qs_ks_methods.mod qs_scf_initialization.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_gamma2kp.F qs_gamma2kp.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:32 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gamma2kp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gamma2kp.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_gamma2kp.mod' due to: qs_gamma2kp.o /build/reproducible-path/cp2k-8.1/src/qs_gamma2kp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_scf_types.mod cp_subsys_types.mod kpoint_types.mod input_section_types.mod qs_environment.mod kinds.mod qs_energy_init.mod qs_ks_methods.mod qs_scf_initialization.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_optimize_ri_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_optimize_ri_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod lri_environment_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod lri_optimize_ri_basis_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod powell.mod kinds.mod lri_environment_init.mod cp_output_handling.mod lri_environment_methods.mod message_passing.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod generic_os_integrals.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_optimize_ri_basis.F lri_optimize_ri_basis.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:53:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_optimize_ri_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_optimize_ri_basis.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_optimize_ri_basis.mod' due to: lri_optimize_ri_basis.o /build/reproducible-path/cp2k-8.1/src/lri_optimize_ri_basis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod lri_environment_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod lri_optimize_ri_basis_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod powell.mod kinds.mod lri_environment_init.mod cp_output_handling.mod lri_environment_methods.mod message_passing.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod generic_os_integrals.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'wannier90.o' due to: /build/reproducible-path/cp2k-8.1/src/wannier90.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 physcon.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/wannier90.F wannier90.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"wannier90.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' wannier90.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'wannier90.mod' due to: wannier90.o /build/reproducible-path/cp2k-8.1/src/wannier90.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 physcon.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'stm_images.o' due to: /build/reproducible-path/cp2k-8.1/src/stm_images.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_mo_types.mod pw_env_types.mod qs_environment_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod input_section_types.mod qs_ks_types.mod cp_fm_struct.mod kinds.mod cp_output_handling.mod cp_array_utils.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_collocate_density.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/stm_images.F stm_images.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:53:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"stm_images.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' stm_images.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'stm_images.mod' due to: stm_images.o /build/reproducible-path/cp2k-8.1/src/stm_images.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_mo_types.mod pw_env_types.mod qs_environment_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod input_section_types.mod qs_ks_types.mod cp_fm_struct.mod kinds.mod cp_output_handling.mod cp_array_utils.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_collocate_density.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_wannier90.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_wannier90.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod scf_control_types.mod cp_fm_pool_types.mod particle_types.mod cell_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_gamma2kp.mod cp_gemm_interface.mod physcon.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_moments.mod cp_dbcsr_operations.mod message_passing.mod qs_matrix_pools.mod cp_para_env.mod cp_files.mod cp_blacs_env.mod machine.mod base_hooks.mod mathconstants.mod qs_scf_diagonalization.mod kpoint_methods.mod wannier90.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_wannier90.F qs_wannier90.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_wannier90.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_wannier90.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_wannier90.mod' due to: qs_wannier90.o /build/reproducible-path/cp2k-8.1/src/qs_wannier90.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod scf_control_types.mod cp_fm_pool_types.mod particle_types.mod cell_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_gamma2kp.mod cp_gemm_interface.mod physcon.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_moments.mod cp_dbcsr_operations.mod message_passing.mod qs_matrix_pools.mod cp_para_env.mod cp_files.mod cp_blacs_env.mod machine.mod base_hooks.mod mathconstants.mod qs_scf_diagonalization.mod kpoint_methods.mod wannier90.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_csr_write.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_neighbor_list_types.mod qs_environment_types.mod kpoint_types.mod cp_log_handling.mod kpoint_methods.mod base_hooks.mod cp_dbcsr_cp2k_link.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F qs_scf_csr_write.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:53:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_csr_write.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_csr_write.F90 -/build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F:275:65: - - 275 | CALL dbcsr_add(cmatrix, tmatrix, cone, ione) - | ^ -Warning: 'tmatrix' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F:273:60: - - 273 | CALL dbcsr_copy(cmatrix, rmatrix_nosym) - | ^ -Warning: 'rmatrix_nosym' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F:274:60: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_chargemol.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_chargemol.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod orbital_transformation_matrices.mod cp_output_handling.mod periodic_table.mod cp_dbcsr_operations.mod cp_files.mod orbital_pointers.mod machine.mod base_hooks.mod orbital_symbols.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_chargemol.F qs_chargemol.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_chargemol.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_chargemol.F90 +/build/reproducible-path/cp2k-8.1/src/qs_chargemol.F:163:83: - 274 | CALL dbcsr_copy(tmatrix, imatrix_nosym) - | ^ -Warning: 'imatrix_nosym' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F:272:68: + 163 | extension=".wfx", my_local=.FALSE.) + | 1 +Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/src/qs_chargemol.F:487:78: - 272 | CALL dbcsr_desymmetrize(imatrix, imatrix_nosym) - | ^ -Warning: 'imatrix' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F:278:70: + 487 | pgf_type_chargemol(bcgf_symbol(icgf) (3:)) + | ^ +Warning: 'label' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_chargemol.F:480:78: - 278 | CALL dbcsr_convert_dbcsr_to_csr(cmatrix, mat_csr) - | ^ -Warning: 'cmatrix' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_csr_write.mod' due to: qs_scf_csr_write.o /build/reproducible-path/cp2k-8.1/src/qs_scf_csr_write.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_neighbor_list_types.mod qs_environment_types.mod kpoint_types.mod cp_log_handling.mod kpoint_methods.mod base_hooks.mod cp_dbcsr_cp2k_link.mod cp_output_handling.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'population_analyses.o' due to: /build/reproducible-path/cp2k-8.1/src/population_analyses.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod cp_dbcsr_operations.mod message_passing.mod particle_methods.mod cp_dbcsr_output.mod base_hooks.mod machine.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/population_analyses.F population_analyses.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:00 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"population_analyses.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' population_analyses.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'population_analyses.mod' due to: population_analyses.o /build/reproducible-path/cp2k-8.1/src/population_analyses.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod cp_dbcsr_operations.mod message_passing.mod particle_methods.mod cp_dbcsr_output.mod base_hooks.mod machine.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molden_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/molden_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_mo_types.mod input_section_types.mod qs_kind_types.mod particle_types.mod cp_fm_types.mod input_constants.mod periodic_table.mod cp_log_handling.mod mathconstants.mod base_hooks.mod orbital_transformation_matrices.mod cp_output_handling.mod cp_dbcsr_operations.mod orbital_pointers.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/molden_utils.F molden_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molden_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molden_utils.F90 -/build/reproducible-path/cp2k-8.1/src/molden_utils.F:81:67: + 480 | pgf_type_chargemol(bcgf_symbol(icgf) (3:)) + | ^ +Warning: 'label' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_chargemol.F:755:22: - 81 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :) :: cmatrix, smatrix - | ^ -Warning: 'cmatrix.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molden_utils.mod' due to: molden_utils.o /build/reproducible-path/cp2k-8.1/src/molden_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_mo_types.mod input_section_types.mod qs_kind_types.mod particle_types.mod cp_fm_types.mod input_constants.mod periodic_table.mod cp_log_handling.mod mathconstants.mod base_hooks.mod orbital_transformation_matrices.mod cp_output_handling.mod cp_dbcsr_operations.mod orbital_pointers.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_pdos.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_pdos.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod preconditioner_types.mod qs_ot_eigensolver.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod message_passing.mod qs_collocate_density.mod orbital_symbols.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod qs_mo_methods.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_pdos.F qs_pdos.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_pdos.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_pdos.F90 -/build/reproducible-path/cp2k-8.1/src/qs_pdos.F:888:21: + 755 | IF (newl) THEN + | ^ +Warning: 'newl' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_chargemol.F:576:49: - 888 | IF (.NOT. read_r(3, ildos)) THEN - | ^ -Warning: 'read_r.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_pdos.F:663:95: + 576 | DO imo = 1, mos(roks_low)%mo_set%homo + | ^ +Warning: 'roks_low' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_chargemol.F:581:78: - 663 | r_ldos_p(ildos)%ldos%pdos_array(imo) = r_ldos_p(ildos)%ldos%pdos_array(imo)*dvol - | ^ -Warning: 'dvol' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_pdos.mod' due to: qs_pdos.o /build/reproducible-path/cp2k-8.1/src/qs_pdos.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod preconditioner_types.mod qs_ot_eigensolver.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod message_passing.mod qs_collocate_density.mod orbital_symbols.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod qs_mo_methods.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_elf_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_elf_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod pw_pool_types.mod pw_env_types.mod qs_environment_types.mod qs_ks_types.mod pw_methods.mod base_hooks.mod mathconstants.mod qs_collocate_density.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_elf_methods.F qs_elf_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_elf_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_elf_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_elf_methods.mod' due to: qs_elf_methods.o /build/reproducible-path/cp2k-8.1/src/qs_elf_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod pw_pool_types.mod pw_env_types.mod qs_environment_types.mod qs_ks_types.mod pw_methods.mod base_hooks.mod mathconstants.mod qs_collocate_density.mod kinds.mod + 581 | DO imo = mos(roks_low)%mo_set%homo + 1, mos(roks_high)%mo_set%homo + | ^ +Warning: 'roks_high' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_chargemol.mod' due to: qs_chargemol.o /build/reproducible-path/cp2k-8.1/src/qs_chargemol.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod orbital_transformation_matrices.mod cp_output_handling.mod periodic_table.mod cp_dbcsr_operations.mod cp_files.mod orbital_pointers.mod machine.mod base_hooks.mod orbital_symbols.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dos.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dos.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod cp_control_types.mod kpoint_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dos.F qs_dos.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:19 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dos.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dos.F90 -/build/reproducible-path/cp2k-8.1/src/qs_dos.F:139:28: - - 139 | nhist = MAXVAL(nmo) - | ^ -Warning: 'nmo[0]' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_dos.F:139:28: Warning: 'nmo[1]' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dos.mod' due to: qs_dos.o /build/reproducible-path/cp2k-8.1/src/qs_dos.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod cp_para_types.mod input_section_types.mod qs_environment_types.mod cp_control_types.mod kpoint_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eigenvalueproblems.mod' due to: eigenvalueproblems.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_energy_window.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_energy_window.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod pw_env_types.mod qs_environment_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod input_section_types.mod qs_ks_types.mod pw_methods.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod iterate_matrix.mod qs_collocate_density.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_energy_window.F qs_energy_window.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_window.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_window.F90 -/build/reproducible-path/cp2k-8.1/src/qs_energy_window.F:142:15: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_electric_field_gradient.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_electric_field_gradient.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod pw_pool_types.mod particle_types.mod qs_rho_types.mod pw_poisson_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_rho_atom_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod qs_harmonics_atom.mod eigenvalueproblems.mod pw_poisson_methods.mod qs_ks_methods.mod util.mod orbital_pointers.mod pw_methods.mod qs_gapw_densities.mod base_hooks.mod mathconstants.mod pw_spline_utils.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_electric_field_gradient.F qs_electric_field_gradient.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_electric_field_gradient.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_electric_field_gradient.F90 +/build/reproducible-path/cp2k-8.1/src/qs_electric_field_gradient.F:106:66: - 142 | stride = section_get_ivals(dft_section, "PRINT%ENERGY_WINDOWS%STRIDE") - | 1 -Warning: POINTER-valued function appears on right-hand side of assignment at (1) [-Wsurprising] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_energy_window.mod' due to: qs_energy_window.o /build/reproducible-path/cp2k-8.1/src/qs_energy_window.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod pw_env_types.mod qs_environment_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod input_section_types.mod qs_ks_types.mod pw_methods.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod iterate_matrix.mod qs_collocate_density.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_wfn_mix.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_wfn_mix.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_kind_types.mod particle_types.mod qs_scf_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod cp_fm_struct.mod qs_mo_io.mod qs_mo_methods.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_wfn_mix.F qs_scf_wfn_mix.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_wfn_mix.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_wfn_mix.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_wfn_mix.mod' due to: qs_scf_wfn_mix.o /build/reproducible-path/cp2k-8.1/src/qs_scf_wfn_mix.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_kind_types.mod particle_types.mod qs_scf_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod cp_fm_struct.mod qs_mo_io.mod qs_mo_methods.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_post_tb.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_post_tb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod qs_mo_types.mod cp_para_types.mod pw_env_types.mod qs_dftb_types.mod cp_control_types.mod particle_types.mod qs_environment_types.mod pw_poisson_types.mod pw_pool_types.mod qs_scf_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod cp_result_types.mod input_section_types.mod xtb_types.mod task_list_types.mod preconditioner_types.mod qs_ks_types.mod pw_grid_types.mod qs_ot_eigensolver.mod input_constants.mod task_list_methods.mod stm_images.mod pw_methods.mod mathconstants.mod cp_fm_diag.mod mulliken.mod cp_fm_struct.mod cp_blacs_env.mod pw_env_methods.mod cp_result_methods.mod kinds.mod qs_mo_io.mod qs_rho_methods.mod qs_scf_csr_write.mod population_analyses.mod molden_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_array_utils.mod physcon.mod qs_dftb_utils.mod qs_pdos.mod qs_elf_methods.mod moments_utils.mod qs_collocate_density.mod qs_dos.mod cp_fm_cholesky.mod memory_utilities.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod cp_realspace_grid_cube.mod qs_energy_window.mod qs_mo_methods.mod machine.mod qs_scf_wfn_mix.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_post_tb.F qs_scf_post_tb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_post_tb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_post_tb.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_post_tb.mod' due to: qs_scf_post_tb.o /build/reproducible-path/cp2k-8.1/src/qs_scf_post_tb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod qs_mo_types.mod cp_para_types.mod pw_env_types.mod qs_dftb_types.mod cp_control_types.mod particle_types.mod qs_environment_types.mod pw_poisson_types.mod pw_pool_types.mod qs_scf_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod cp_result_types.mod input_section_types.mod xtb_types.mod task_list_types.mod preconditioner_types.mod qs_ks_types.mod pw_grid_types.mod qs_ot_eigensolver.mod input_constants.mod task_list_methods.mod stm_images.mod pw_methods.mod mathconstants.mod cp_fm_diag.mod mulliken.mod cp_fm_struct.mod cp_blacs_env.mod pw_env_methods.mod cp_result_methods.mod kinds.mod qs_mo_io.mod qs_rho_methods.mod qs_scf_csr_write.mod population_analyses.mod molden_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_array_utils.mod physcon.mod qs_dftb_utils.mod qs_pdos.mod qs_elf_methods.mod moments_utils.mod qs_collocate_density.mod qs_dos.mod cp_fm_cholesky.mod memory_utilities.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod cp_realspace_grid_cube.mod qs_energy_window.mod qs_mo_methods.mod machine.mod qs_scf_wfn_mix.mod + 106 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: efg_pw, efg_tensor + | ^ +Warning: 'efg_pw.dim[2].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_electric_field_gradient.mod' due to: qs_electric_field_gradient.o /build/reproducible-path/cp2k-8.1/src/qs_electric_field_gradient.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod pw_pool_types.mod particle_types.mod qs_rho_types.mod pw_poisson_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_rho_atom_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod qs_harmonics_atom.mod eigenvalueproblems.mod pw_poisson_methods.mod qs_ks_methods.mod util.mod orbital_pointers.mod pw_methods.mod qs_gapw_densities.mod base_hooks.mod mathconstants.mod pw_spline_utils.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'commutator_rkinetic.o' due to: /build/reproducible-path/cp2k-8.1/src/commutator_rkinetic.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod qs_neighbor_list_types.mod ai_contraction.mod qs_integral_utils.mod base_hooks.mod ai_kinetic.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'commutator_rkinetic.o' due to: /build/reproducible-path/cp2k-8.1/src/commutator_rkinetic.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_kinetic.mod qs_integral_utils.mod ai_contraction.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/commutator_rkinetic.F commutator_rkinetic.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"commutator_rkinetic.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' commutator_rkinetic.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'commutator_rkinetic.mod' due to: commutator_rkinetic.o /build/reproducible-path/cp2k-8.1/src/commutator_rkinetic.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_kind_types.mod qs_neighbor_list_types.mod ai_contraction.mod qs_integral_utils.mod base_hooks.mod ai_kinetic.mod orbital_pointers.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:00:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"commutator_rkinetic.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' commutator_rkinetic.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'commutator_rkinetic.mod' due to: commutator_rkinetic.o /build/reproducible-path/cp2k-8.1/src/commutator_rkinetic.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod kinds.mod orbital_pointers.mod base_hooks.mod ai_kinetic.mod qs_integral_utils.mod ai_contraction.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_commutators.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_commutators.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cp_control_types.mod base_hooks.mod commutator_rkinetic.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod kinds.mod commutator_rpnl.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_commutators.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_commutators.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_neighbor_list_types.mod cp_control_types.mod qs_kind_types.mod commutator_rpnl.mod kinds.mod base_hooks.mod cp_dbcsr_cp2k_link.mod commutator_rkinetic.mod cp_dbcsr_operations.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_commutators.F qs_commutators.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_commutators.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_commutators.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_commutators.mod' due to: qs_commutators.o /build/reproducible-path/cp2k-8.1/src/qs_commutators.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cp_control_types.mod base_hooks.mod commutator_rkinetic.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod kinds.mod commutator_rpnl.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_external_density.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_external_density.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod qs_rho_types.mod realspace_grid_types.mod input_section_types.mod pw_types.mod pw_env_types.mod qs_environment_types.mod cell_types.mod rs_pw_interface.mod pw_methods.mod gaussian_gridlevels.mod message_passing.mod cp_files.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_external_density.F qs_external_density.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_external_density.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_external_density.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_external_density.mod' due to: qs_external_density.o /build/reproducible-path/cp2k-8.1/src/qs_external_density.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod qs_rho_types.mod realspace_grid_types.mod input_section_types.mod pw_types.mod pw_env_types.mod qs_environment_types.mod cell_types.mod rs_pw_interface.mod pw_methods.mod gaussian_gridlevels.mod message_passing.mod cp_files.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_core_matrix.o' due to: /build/reproducible-path/cp2k-8.1/src/se_core_matrix.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod semi_empirical_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod semi_empirical_int_arrays.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod physcon.mod virial_methods.mod semi_empirical_utils.mod qs_overlap.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_core_matrix.F se_core_matrix.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:51 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_core_matrix.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_core_matrix.F90 -/build/reproducible-path/cp2k-8.1/src/se_core_matrix.F:427:19: - - 427 | SUBROUTINE makeS(R, nra, nrb, ZSA, ZSB, ZPA, ZPB, S) - | ^ -Warning: 'makes' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/se_core_matrix.F:803:20: - - 803 | SUBROUTINE makedS(R, nra, nrb, ZSA, ZSB, ZPA, ZPB, dS) - | ^ -Warning: 'makeds' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/se_core_matrix.F:373:66: - - 373 | force(jkind)%all_potential(:, atom_b) + force_ab(:) - | ^ -Warning: 'atom_b' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/se_core_matrix.F:371:66: - - 371 | force(ikind)%all_potential(:, atom_a) - force_ab(:) - | ^ -Warning: 'atom_a' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_core_matrix.mod' due to: se_core_matrix.o /build/reproducible-path/cp2k-8.1/src/se_core_matrix.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod semi_empirical_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod semi_empirical_int_arrays.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod physcon.mod virial_methods.mod semi_empirical_utils.mod qs_overlap.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_dftb_dispersion.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_dftb_dispersion.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_kind_types.mod qs_dispersion_types.mod cp_para_types.mod virial_types.mod qs_dftb_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atprop_types.mod atomic_kind_types.mod qs_force_types.mod qs_energy_types.mod input_constants.mod kinds.mod virial_methods.mod qs_dftb_utils.mod qs_dispersion_pairpot.mod message_passing.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_dftb_dispersion.F qs_dftb_dispersion.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_dftb_dispersion.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_dftb_dispersion.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_dftb_dispersion.mod' due to: qs_dftb_dispersion.o /build/reproducible-path/cp2k-8.1/src/qs_dftb_dispersion.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_kind_types.mod qs_dispersion_types.mod cp_para_types.mod virial_types.mod qs_dftb_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atprop_types.mod atomic_kind_types.mod qs_force_types.mod qs_energy_types.mod input_constants.mod kinds.mod virial_methods.mod qs_dftb_utils.mod qs_dispersion_pairpot.mod message_passing.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'maxwell_solver_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/maxwell_solver_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cp_control_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/maxwell_solver_interface.F maxwell_solver_interface.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"maxwell_solver_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' maxwell_solver_interface.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'maxwell_solver_interface.mod' due to: maxwell_solver_interface.o /build/reproducible-path/cp2k-8.1/src/maxwell_solver_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cp_control_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_external_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_external_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod qs_kind_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_energy_types.mod pw_grid_types.mod string_utilities.mod force_fields_util.mod kinds.mod message_passing.mod fparser.mod maxwell_solver_interface.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_external_potential.F qs_external_potential.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:54:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_external_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_external_potential.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_external_potential.mod' due to: qs_external_potential.o /build/reproducible-path/cp2k-8.1/src/qs_external_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod cell_types.mod qs_kind_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_energy_types.mod pw_grid_types.mod string_utilities.mod force_fields_util.mod kinds.mod message_passing.mod fparser.mod maxwell_solver_interface.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'se_core_core.o' due to: /build/reproducible-path/cp2k-8.1/src/se_core_core.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atprop_types.mod semi_empirical_types.mod atomic_kind_types.mod ewald_pw_types.mod qs_force_types.mod ewald_environment_types.mod qs_energy_types.mod input_constants.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod kinds.mod virial_methods.mod semi_empirical_utils.mod message_passing.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/se_core_core.F se_core_core.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:55:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"se_core_core.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' se_core_core.F90 -/build/reproducible-path/cp2k-8.1/src/se_core_core.F:213:53: - - 213 | dr3inv = -3.0_dp*rij*r3inv*r2inv - | ^ -Warning: 'r3inv' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/se_core_core.F:213:53: Warning: 'r2inv' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'se_core_core.mod' due to: se_core_core.o /build/reproducible-path/cp2k-8.1/src/se_core_core.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atprop_types.mod semi_empirical_types.mod atomic_kind_types.mod ewald_pw_types.mod qs_force_types.mod ewald_environment_types.mod qs_energy_types.mod input_constants.mod semi_empirical_integrals.mod semi_empirical_int_arrays.mod kinds.mod virial_methods.mod semi_empirical_utils.mod message_passing.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_gcp_method.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod qs_kind_types.mod virial_types.mod qs_force_types.mod qs_neighbor_list_types.mod atprop_types.mod qs_gcp_types.mod qs_environment_types.mod cell_types.mod particle_types.mod virial_methods.mod ai_overlap.mod cp_log_handling.mod message_passing.mod base_hooks.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F qs_gcp_method.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:55:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gcp_method.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gcp_method.F90 -/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:286:13: - - 286 | IF (use_virial) THEN - | ^ -Warning: 'use_virial' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:236:80: - - 236 | CALL virial_pair_force(atstr(:, :, iatom), -0.5_dp, fdij, rij) - | ^ -Warning: 'atstr.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:236:80: Warning: 'atstr.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:237:80: - - 237 | CALL virial_pair_force(atstr(:, :, jatom), -0.5_dp, fdij, rij) - | ^ -Warning: 'atstr.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:86:65: - - 86 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: atstr - | ^ -Warning: 'atstr.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:86:65: Warning: 'atstr.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:86:65: Warning: 'atstr.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:86:65: Warning: 'atstr.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:86:65: Warning: 'atstr.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F:236:80: - - 236 | CALL virial_pair_force(atstr(:, :, iatom), -0.5_dp, fdij, rij) - | ^ -Warning: 'atstr.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_gcp_method.mod' due to: qs_gcp_method.o /build/reproducible-path/cp2k-8.1/src/qs_gcp_method.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod qs_kind_types.mod virial_types.mod qs_force_types.mod qs_neighbor_list_types.mod atprop_types.mod qs_gcp_types.mod qs_environment_types.mod cell_types.mod particle_types.mod virial_methods.mod ai_overlap.mod cp_log_handling.mod message_passing.mod base_hooks.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optimize_embedding_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/optimize_embedding_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod xc_rho_set_types.mod lri_environment_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod embed_types.mod particle_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod pw_pool_types.mod particle_list_types.mod force_env_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod input_constants.mod pw_methods.mod mathconstants.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod cp_files.mod kinds.mod pw_poisson_methods.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod mixed_environment_utils.mod message_passing.mod qs_integrate_potential_single.mod qs_collocate_density.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod xc.mod qs_kinetic.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/optimize_embedding_potential.F optimize_embedding_potential.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:55:10 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_embedding_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_embedding_potential.F90 -/build/reproducible-path/cp2k-8.1/src/optimize_embedding_potential.F:1977:32: - - 1977 | SUBROUTINE inv_Hessian_update(grad, prev_grad, step, prev_inv_Hess, inv_Hess) - | ^ -Warning: 'inv_hessian_update' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/optimize_embedding_potential.F:2085:28: - - 2085 | SUBROUTINE Hessian_update(grad, prev_grad, step, prev_Hess, Hess) - | ^ -Warning: 'hessian_update' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/optimize_embedding_potential.F:3430:40: - - 3430 | CALL pw_release(pot_beta%pw) - | ^ -Warning: 'pot_beta' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optimize_embedding_potential.mod' due to: optimize_embedding_potential.o /build/reproducible-path/cp2k-8.1/src/optimize_embedding_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod xc_rho_set_types.mod lri_environment_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod embed_types.mod particle_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod pw_pool_types.mod particle_list_types.mod force_env_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod input_constants.mod pw_methods.mod mathconstants.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod cp_files.mod kinds.mod pw_poisson_methods.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod mixed_environment_utils.mod message_passing.mod qs_integrate_potential_single.mod qs_collocate_density.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod xc.mod qs_kinetic.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_energy_init.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_energy_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kpoint_types.mod qs_dispersion_types.mod lri_environment_types.mod cp_para_types.mod qs_gcp_types.mod qs_environment_types.mod cp_control_types.mod kg_environment_types.mod input_section_types.mod qs_ks_types.mod molecule_types.mod qs_energy_types.mod qs_external_density.mod input_constants.mod ri_environment_methods.mod se_core_matrix.mod xtb_matrices.mod qs_ks_methods.mod qs_dftb_matrices.mod qs_dftb_dispersion.mod qs_core_energies.mod kinds.mod qs_external_potential.mod qs_core_hamiltonian.mod kpoint_methods.mod qs_update_s_mstruct.mod efield_utils.mod cp_dbcsr_operations.mod lri_environment_methods.mod se_core_core.mod qs_dispersion_pairpot.mod base_hooks.mod qs_gcp_method.mod qs_neighbor_lists.mod optimize_embedding_potential.mod kg_environment.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_energy_init.F qs_energy_init.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:55:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_init.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_energy_init.mod' due to: qs_energy_init.o /build/reproducible-path/cp2k-8.1/src/qs_energy_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod kpoint_types.mod qs_dispersion_types.mod lri_environment_types.mod cp_para_types.mod qs_gcp_types.mod qs_environment_types.mod cp_control_types.mod kg_environment_types.mod input_section_types.mod qs_ks_types.mod molecule_types.mod qs_energy_types.mod qs_external_density.mod input_constants.mod ri_environment_methods.mod se_core_matrix.mod xtb_matrices.mod qs_ks_methods.mod qs_dftb_matrices.mod qs_dftb_dispersion.mod qs_core_energies.mod kinds.mod qs_external_potential.mod qs_core_hamiltonian.mod kpoint_methods.mod qs_update_s_mstruct.mod efield_utils.mod cp_dbcsr_operations.mod lri_environment_methods.mod se_core_core.mod qs_dispersion_pairpot.mod base_hooks.mod qs_gcp_method.mod qs_neighbor_lists.mod optimize_embedding_potential.mod kg_environment.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:01:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_commutators.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_commutators.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_commutators.mod' due to: qs_commutators.o /build/reproducible-path/cp2k-8.1/src/qs_commutators.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_neighbor_list_types.mod cp_control_types.mod qs_kind_types.mod commutator_rpnl.mod kinds.mod base_hooks.mod cp_dbcsr_cp2k_link.mod commutator_rkinetic.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_gamma2kp.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_gamma2kp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_subsys_types.mod qs_scf_types.mod qs_environment_types.mod kpoint_types.mod qs_environment.mod qs_scf_initialization.mod base_hooks.mod qs_ks_methods.mod qs_energy_init.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_gamma2kp.F qs_gamma2kp.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:55:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_gamma2kp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_gamma2kp.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_gamma2kp.mod' due to: qs_gamma2kp.o /build/reproducible-path/cp2k-8.1/src/qs_gamma2kp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_subsys_types.mod qs_scf_types.mod qs_environment_types.mod kpoint_types.mod qs_environment.mod qs_scf_initialization.mod base_hooks.mod qs_ks_methods.mod qs_energy_init.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_local_properties.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_local_properties.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod bibliography.mod cp_dbcsr_operations.mod qs_collocate_density.mod qs_vxc.mod qs_ks_methods.mod mathlib.mod qs_core_energies.mod pw_methods.mod base_hooks.mod qs_energy_matrix_w.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_local_properties.F qs_local_properties.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:01:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_local_properties.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_local_properties.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_local_properties.mod' due to: qs_local_properties.o /build/reproducible-path/cp2k-8.1/src/qs_local_properties.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qs_ks_types.mod qs_rho_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod bibliography.mod cp_dbcsr_operations.mod qs_collocate_density.mod qs_vxc.mod qs_ks_methods.mod mathlib.mod qs_core_energies.mod pw_methods.mod base_hooks.mod qs_energy_matrix_w.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'wannier90.o' due to: /build/reproducible-path/cp2k-8.1/src/wannier90.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 physcon.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/wannier90.F wannier90.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:55:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"wannier90.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' wannier90.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'wannier90.mod' due to: wannier90.o /build/reproducible-path/cp2k-8.1/src/wannier90.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 physcon.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_loc_dipole.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_loc_dipole.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_loc_types.mod cp_result_types.mod qs_kind_types.mod particle_types.mod cell_types.mod input_section_types.mod atomic_kind_types.mod cp_result_methods.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod physcon.mod moments_utils.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_loc_dipole.F qs_loc_dipole.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:01:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_dipole.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_dipole.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_loc_dipole.mod' due to: qs_loc_dipole.o /build/reproducible-path/cp2k-8.1/src/qs_loc_dipole.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_loc_types.mod cp_result_types.mod qs_kind_types.mod particle_types.mod cell_types.mod input_section_types.mod atomic_kind_types.mod cp_result_methods.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod physcon.mod moments_utils.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_wannier90.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_wannier90.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod cp_gemm_interface.mod mathconstants.mod cp_fm_struct.mod cp_blacs_env.mod cp_files.mod qs_matrix_pools.mod kinds.mod kpoint_methods.mod cp_dbcsr_operations.mod physcon.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_para_env.mod qs_gamma2kp.mod qs_scf_diagonalization.mod wannier90.mod cp_log_handling.mod base_hooks.mod qs_moments.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_wannier90.F qs_wannier90.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:55:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_wannier90.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_wannier90.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_wannier90.mod' due to: qs_wannier90.o /build/reproducible-path/cp2k-8.1/src/qs_wannier90.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod cp_gemm_interface.mod mathconstants.mod cp_fm_struct.mod cp_blacs_env.mod cp_files.mod qs_matrix_pools.mod kinds.mod kpoint_methods.mod cp_dbcsr_operations.mod physcon.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_para_env.mod qs_gamma2kp.mod qs_scf_diagonalization.mod wannier90.mod cp_log_handling.mod base_hooks.mod qs_moments.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mao_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/mao_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_control_types.mod basis_set_container_types.mod kinds.mod cp_dbcsr_cp2k_link.mod qs_interactions.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod lapack.mod iterate_matrix.mod base_hooks.mod cp_fm_diag.mod input_constants.mod kpoint_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mao_methods.F mao_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:01:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mao_methods.mod' due to: mao_methods.o /build/reproducible-path/cp2k-8.1/src/mao_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_control_types.mod basis_set_container_types.mod kinds.mod cp_dbcsr_cp2k_link.mod qs_interactions.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod lapack.mod iterate_matrix.mod base_hooks.mod cp_fm_diag.mod input_constants.mod kpoint_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_epr_hyp.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_epr_hyp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_rho_atom_types.mod pw_pool_types.mod atomic_kind_types.mod input_section_types.mod pw_grid_types.mod pw_methods.mod mathconstants.mod util.mod kinds.mod qs_harmonics_atom.mod cp_output_handling.mod physcon.mod message_passing.mod qs_grid_atom.mod periodic_table.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_epr_hyp.F qs_epr_hyp.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:55:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_epr_hyp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_epr_hyp.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_epr_hyp.mod' due to: qs_epr_hyp.o /build/reproducible-path/cp2k-8.1/src/qs_epr_hyp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_rho_atom_types.mod pw_pool_types.mod atomic_kind_types.mod input_section_types.mod pw_grid_types.mod pw_methods.mod mathconstants.mod util.mod kinds.mod qs_harmonics_atom.mod cp_output_handling.mod physcon.mod message_passing.mod qs_grid_atom.mod periodic_table.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mao_optimizer.o' due to: /build/reproducible-path/cp2k-8.1/src/mao_optimizer.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod mao_methods.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mao_optimizer.F mao_optimizer.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:01:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_optimizer.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_optimizer.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mao_optimizer.mod' due to: mao_optimizer.o /build/reproducible-path/cp2k-8.1/src/mao_optimizer.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod mao_methods.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mao_wfn_analysis.o' due to: /build/reproducible-path/cp2k-8.1/src/mao_wfn_analysis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod cp_blacs_env.mod kinds.mod cp_dbcsr_operations.mod mao_optimizer.mod mao_methods.mod message_passing.mod iterate_matrix.mod cp_dbcsr_cholesky.mod cp_dbcsr_cp2k_link.mod bibliography.mod qs_overlap.mod particle_methods.mod mathlib.mod base_hooks.mod qs_neighbor_lists.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mao_wfn_analysis.o' due to: /build/reproducible-path/cp2k-8.1/src/mao_wfn_analysis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod kinds.mod cp_dbcsr_cp2k_link.mod mao_optimizer.mod bibliography.mod mao_methods.mod message_passing.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod mathlib.mod cp_dbcsr_cholesky.mod iterate_matrix.mod particle_methods.mod cp_blacs_env.mod base_hooks.mod qs_overlap.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mao_wfn_analysis.F mao_wfn_analysis.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:55:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_wfn_analysis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_wfn_analysis.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:01:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_wfn_analysis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_wfn_analysis.F90 /build/reproducible-path/cp2k-8.1/src/mao_wfn_analysis.F:106:85: 106 | qmatbc, raq, sab, selnABC, sinv, & @@ -45363,135 +44923,16 @@ Warning: 'selnabc.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/mao_wfn_analysis.F:106:85: Warning: 'selnabc.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/mao_wfn_analysis.F:106:85: Warning: 'selnabc.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mao_wfn_analysis.mod' due to: mao_wfn_analysis.o /build/reproducible-path/cp2k-8.1/src/mao_wfn_analysis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod cp_blacs_env.mod kinds.mod cp_dbcsr_operations.mod mao_optimizer.mod mao_methods.mod message_passing.mod iterate_matrix.mod cp_dbcsr_cholesky.mod cp_dbcsr_cp2k_link.mod bibliography.mod qs_overlap.mod particle_methods.mod mathlib.mod base_hooks.mod qs_neighbor_lists.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'voronoi_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/voronoi_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod particle_list_types.mod atomic_kind_types.mod input_section_types.mod pw_grid_types.mod input_constants.mod kinds.mod physcon.mod message_passing.mod bibliography.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/voronoi_interface.F voronoi_interface.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:56:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"voronoi_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' voronoi_interface.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'voronoi_interface.mod' due to: voronoi_interface.o /build/reproducible-path/cp2k-8.1/src/voronoi_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod particle_list_types.mod atomic_kind_types.mod input_section_types.mod pw_grid_types.mod input_constants.mod kinds.mod physcon.mod message_passing.mod bibliography.mod cp_log_handling.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_active_space_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_active_space_types.mod qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_loc_types.mod pw_poisson_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod task_list_types.mod qs_ks_types.mod qs_energy_types.mod pw_grid_types.mod input_constants.mod task_list_methods.mod pw_methods.mod mathconstants.mod cp_gemm_interface.mod qs_ks_methods.mod cp_fm_diag.mod cp_fm_struct.mod cp_files.mod pw_env_methods.mod kinds.mod cp_fm_vect.mod pw_poisson_methods.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_loc_methods.mod message_passing.mod qs_collocate_density.mod memory_utilities.mod periodic_table.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod qs_loc_utils.mod qs_mo_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F qs_active_space_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:56:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_active_space_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_active_space_methods.F90 -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1179:82: - - 1179 | wfn_r%pw%cr3d = rho_r%pw%cr3d*wfn3%pw%cr3d*wfn4%pw%cr3d - | ^ -Warning: 'wfn4' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:981:82: - - 981 | TYPE(pw_p_type), POINTER :: wfn1, wfn2, wfn3, wfn4 - | ^ -note: 'wfn4' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1179:82: - - 1179 | wfn_r%pw%cr3d = rho_r%pw%cr3d*wfn3%pw%cr3d*wfn4%pw%cr3d - | ^ -Warning: 'wfn3' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:981:76: - - 981 | TYPE(pw_p_type), POINTER :: wfn1, wfn2, wfn3, wfn4 - | ^ -note: 'wfn3' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1142:56: - - 1142 | rho_r%pw%cr3d = wfn1%pw%cr3d*wfn2%pw%cr3d - | ^ -Warning: 'wfn2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:981:70: - - 981 | TYPE(pw_p_type), POINTER :: wfn1, wfn2, wfn3, wfn4 - | ^ -note: 'wfn2' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1142:56: - - 1142 | rho_r%pw%cr3d = wfn1%pw%cr3d*wfn2%pw%cr3d - | ^ -Warning: 'wfn1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:981:64: - - 981 | TYPE(pw_p_type), POINTER :: wfn1, wfn2, wfn3, wfn4 - | ^ -note: 'wfn1' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:980:65: - - 980 | TYPE(pw_p_type), DIMENSION(:, :), POINTER :: wfn_a - | ^ -Warning: 'wfn_a.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:980:65: Warning: 'wfn_a.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:980:65: Warning: 'wfn_a.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1100:31: - - 1100 | IF (print2 .AND. iw > 0) THEN - | ^ -Warning: 'print2' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:965:74: - - 965 | LOGICAL :: print1, print2, & - | ^ -note: 'print2' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1205:22: - - 1205 | IF (print1 .AND. iw > 0) THEN - | ^ -Warning: 'print1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:965:66: - - 965 | LOGICAL :: print1, print2, & - | ^ -note: 'print1' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:1996:65: - - 1996 | ALLOCATE (nq(ishell), lq(ishell), zet(ishell), sym(ishell)) - | ^ -Warning: 'ishell' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F:187:78: - - 187 | INTEGER :: eri_method, eri_operator, eri_print, handle, i, iatom, ishell, isp, ispin, iw, j, & - | ^ -note: 'ishell' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_active_space_methods.mod' due to: qs_active_space_methods.o /build/reproducible-path/cp2k-8.1/src/qs_active_space_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_active_space_types.mod qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_loc_types.mod pw_poisson_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod task_list_types.mod qs_ks_types.mod qs_energy_types.mod pw_grid_types.mod input_constants.mod task_list_methods.mod pw_methods.mod mathconstants.mod cp_gemm_interface.mod qs_ks_methods.mod cp_fm_diag.mod cp_fm_struct.mod cp_files.mod pw_env_methods.mod kinds.mod cp_fm_vect.mod pw_poisson_methods.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_loc_methods.mod message_passing.mod qs_collocate_density.mod memory_utilities.mod periodic_table.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod qs_loc_utils.mod qs_mo_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_local_properties.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_local_properties.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod pw_pool_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod pw_methods.mod qs_ks_methods.mod qs_core_energies.mod qs_vxc.mod kinds.mod cp_dbcsr_operations.mod qs_collocate_density.mod bibliography.mod qs_energy_matrix_w.mod mathlib.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_local_properties.F qs_local_properties.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:56:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_local_properties.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_local_properties.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_local_properties.mod' due to: qs_local_properties.o /build/reproducible-path/cp2k-8.1/src/qs_local_properties.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod pw_pool_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod pw_methods.mod qs_ks_methods.mod qs_core_energies.mod qs_vxc.mod kinds.mod cp_dbcsr_operations.mod qs_collocate_density.mod bibliography.mod qs_energy_matrix_w.mod mathlib.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mao_wfn_analysis.mod' due to: mao_wfn_analysis.o /build/reproducible-path/cp2k-8.1/src/mao_wfn_analysis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod kinds.mod cp_dbcsr_cp2k_link.mod mao_optimizer.mod bibliography.mod mao_methods.mod message_passing.mod cp_dbcsr_operations.mod qs_neighbor_lists.mod mathlib.mod cp_dbcsr_cholesky.mod iterate_matrix.mod particle_methods.mod cp_blacs_env.mod base_hooks.mod qs_overlap.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'minbas_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/minbas_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod qs_ks_types.mod lapack.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod particle_methods.mod base_hooks.mod mao_basis.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/minbas_methods.F minbas_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:56:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minbas_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minbas_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'minbas_methods.mod' due to: minbas_methods.o /build/reproducible-path/cp2k-8.1/src/minbas_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod qs_ks_types.mod lapack.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod particle_methods.mod base_hooks.mod mao_basis.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'minbas_wfn_analysis.o' due to: /build/reproducible-path/cp2k-8.1/src/minbas_wfn_analysis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_subsys_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod cp_gemm_interface.mod mulliken.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod minbas_methods.mod atomic_charges.mod molden_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod iterate_matrix.mod qs_collocate_density.mod bibliography.mod particle_methods.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod qs_mo_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/minbas_wfn_analysis.F minbas_wfn_analysis.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:56:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minbas_wfn_analysis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minbas_wfn_analysis.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'minbas_wfn_analysis.mod' due to: minbas_wfn_analysis.o /build/reproducible-path/cp2k-8.1/src/minbas_wfn_analysis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_subsys_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod cp_gemm_interface.mod mulliken.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod minbas_methods.mod atomic_charges.mod molden_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod iterate_matrix.mod qs_collocate_density.mod bibliography.mod particle_methods.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod qs_mo_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eigenvalueproblems.mod' due to: eigenvalueproblems.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_electric_field_gradient.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_electric_field_gradient.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod paw_proj_set_types.mod cp_control_types.mod particle_types.mod qs_environment_types.mod qs_rho_atom_types.mod pw_poisson_types.mod pw_pool_types.mod atomic_kind_types.mod input_section_types.mod pw_methods.mod mathconstants.mod qs_ks_methods.mod qs_gapw_densities.mod util.mod kinds.mod pw_poisson_methods.mod qs_harmonics_atom.mod cp_output_handling.mod physcon.mod message_passing.mod eigenvalueproblems.mod cp_log_handling.mod base_hooks.mod pw_spline_utils.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_electric_field_gradient.F qs_electric_field_gradient.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:56:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_electric_field_gradient.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_electric_field_gradient.F90 -/build/reproducible-path/cp2k-8.1/src/qs_electric_field_gradient.F:106:66: - - 106 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: efg_pw, efg_tensor - | ^ -Warning: 'efg_pw.dim[2].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_electric_field_gradient.mod' due to: qs_electric_field_gradient.o /build/reproducible-path/cp2k-8.1/src/qs_electric_field_gradient.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod paw_proj_set_types.mod cp_control_types.mod particle_types.mod qs_environment_types.mod qs_rho_atom_types.mod pw_poisson_types.mod pw_pool_types.mod atomic_kind_types.mod input_section_types.mod pw_methods.mod mathconstants.mod qs_ks_methods.mod qs_gapw_densities.mod util.mod kinds.mod pw_poisson_methods.mod qs_harmonics_atom.mod cp_output_handling.mod physcon.mod message_passing.mod eigenvalueproblems.mod cp_log_handling.mod base_hooks.mod pw_spline_utils.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xray_diffraction.o' due to: /build/reproducible-path/cp2k-8.1/src/xray_diffraction.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod paw_proj_set_types.mod cp_control_types.mod qs_environment_types.mod particle_types.mod qs_rho_atom_types.mod pw_pool_types.mod atomic_kind_types.mod pw_methods.mod mathconstants.mod pw_grids.mod util.mod kinds.mod physcon.mod message_passing.mod bibliography.mod memory_utilities.mod base_hooks.mod orbital_transformation_matrices.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xray_diffraction.F xray_diffraction.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:56:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xray_diffraction.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xray_diffraction.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xray_diffraction.mod' due to: xray_diffraction.o /build/reproducible-path/cp2k-8.1/src/xray_diffraction.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod paw_proj_set_types.mod cp_control_types.mod qs_environment_types.mod particle_types.mod qs_rho_atom_types.mod pw_pool_types.mod atomic_kind_types.mod pw_methods.mod mathconstants.mod pw_grids.mod util.mod kinds.mod physcon.mod message_passing.mod bibliography.mod memory_utilities.mod base_hooks.mod orbital_transformation_matrices.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'uff_vdw_radii_table.o' due to: /build/reproducible-path/cp2k-8.1/src/uff_vdw_radii_table.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'uff_vdw_radii_table.o' due to: /build/reproducible-path/cp2k-8.1/src/uff_vdw_radii_table.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/uff_vdw_radii_table.F uff_vdw_radii_table.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:56:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"uff_vdw_radii_table.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' uff_vdw_radii_table.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'uff_vdw_radii_table.mod' due to: uff_vdw_radii_table.o /build/reproducible-path/cp2k-8.1/src/uff_vdw_radii_table.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:01:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"uff_vdw_radii_table.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' uff_vdw_radii_table.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'uff_vdw_radii_table.mod' due to: uff_vdw_radii_table.o /build/reproducible-path/cp2k-8.1/src/uff_vdw_radii_table.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_resp.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_resp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod particle_list_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod pw_methods.mod mathconstants.mod kinds.mod kahan_sum.mod pw_poisson_methods.mod atomic_charges.mod cp_output_handling.mod message_passing.mod qs_collocate_density.mod bibliography.mod memory_utilities.mod periodic_table.mod cp_log_handling.mod uff_vdw_radii_table.mod base_hooks.mod cp_realspace_grid_cube.mod machine.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_resp.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_resp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod uff_vdw_radii_table.mod kinds.mod atomic_charges.mod cp_output_handling.mod periodic_table.mod bibliography.mod message_passing.mod kahan_sum.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod qs_collocate_density.mod memory_utilities.mod pw_methods.mod machine.mod base_hooks.mod mathconstants.mod input_constants.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_resp.F qs_resp.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:56:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_resp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_resp.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:01:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_resp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_resp.F90 /build/reproducible-path/cp2k-8.1/src/qs_resp.F:1111:25: 1111 | IF (dist(m) < rmin + delta) not_in_range(m, 1) = .TRUE. @@ -45562,134 +45003,197 @@ 777 | REAL(KIND=dp) :: delta, dh(3, 3), dvol, r(3), rmax, rmin, & | ^ note: 'rmax' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_resp.mod' due to: qs_resp.o /build/reproducible-path/cp2k-8.1/src/qs_resp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod particle_list_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod pw_methods.mod mathconstants.mod kinds.mod kahan_sum.mod pw_poisson_methods.mod atomic_charges.mod cp_output_handling.mod message_passing.mod qs_collocate_density.mod bibliography.mod memory_utilities.mod periodic_table.mod cp_log_handling.mod uff_vdw_radii_table.mod base_hooks.mod cp_realspace_grid_cube.mod machine.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_resp.mod' due to: qs_resp.o /build/reproducible-path/cp2k-8.1/src/qs_resp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod uff_vdw_radii_table.mod kinds.mod atomic_charges.mod cp_output_handling.mod periodic_table.mod bibliography.mod message_passing.mod kahan_sum.mod cp_realspace_grid_cube.mod pw_poisson_methods.mod qs_collocate_density.mod memory_utilities.mod pw_methods.mod machine.mod base_hooks.mod mathconstants.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_chargemol.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_chargemol.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_subsys_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod qs_force_types.mod qs_energy_types.mod cp_files.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod orbital_symbols.mod periodic_table.mod cp_log_handling.mod base_hooks.mod orbital_transformation_matrices.mod machine.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_chargemol.F qs_chargemol.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:57:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_chargemol.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_chargemol.F90 -/build/reproducible-path/cp2k-8.1/src/qs_chargemol.F:163:83: - - 163 | extension=".wfx", my_local=.FALSE.) - | 1 -Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/src/qs_chargemol.F:487:78: - - 487 | pgf_type_chargemol(bcgf_symbol(icgf) (3:)) - | ^ -Warning: 'label' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_chargemol.F:480:78: - - 480 | pgf_type_chargemol(bcgf_symbol(icgf) (3:)) - | ^ -Warning: 'label' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_chargemol.F:755:22: - - 755 | IF (newl) THEN - | ^ -Warning: 'newl' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_chargemol.F:576:49: - - 576 | DO imo = 1, mos(roks_low)%mo_set%homo - | ^ -Warning: 'roks_low' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_chargemol.F:581:78: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_epr_hyp.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_epr_hyp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_rho_atom_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod periodic_table.mod qs_harmonics_atom.mod message_passing.mod qs_grid_atom.mod util.mod pw_methods.mod base_hooks.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_epr_hyp.F qs_epr_hyp.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:01:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_epr_hyp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_epr_hyp.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_epr_hyp.mod' due to: qs_epr_hyp.o /build/reproducible-path/cp2k-8.1/src/qs_epr_hyp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_rho_atom_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod periodic_table.mod qs_harmonics_atom.mod message_passing.mod qs_grid_atom.mod util.mod pw_methods.mod base_hooks.mod mathconstants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecular_moments.o' due to: /build/reproducible-path/cp2k-8.1/src/molecular_moments.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_fm_struct.mod qs_moments.mod cp_dbcsr_operations.mod message_passing.mod moments_utils.mod cp_fm_basic_linalg.mod orbital_pointers.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/molecular_moments.F molecular_moments.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:01:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molecular_moments.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecular_moments.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molecular_moments.mod' due to: molecular_moments.o /build/reproducible-path/cp2k-8.1/src/molecular_moments.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_fm_struct.mod qs_moments.mod cp_dbcsr_operations.mod message_passing.mod moments_utils.mod cp_fm_basic_linalg.mod orbital_pointers.mod base_hooks.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecular_dipoles.o' due to: /build/reproducible-path/cp2k-8.1/src/molecular_dipoles.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod qs_loc_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod moments_utils.mod base_hooks.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/molecular_dipoles.F molecular_dipoles.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:01:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molecular_dipoles.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecular_dipoles.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molecular_dipoles.mod' due to: molecular_dipoles.o /build/reproducible-path/cp2k-8.1/src/molecular_dipoles.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod qs_loc_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod moments_utils.mod base_hooks.mod mathconstants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'molecular_states.o' due to: /build/reproducible-path/cp2k-8.1/src/molecular_states.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod cp_realspace_grid_cube.mod qs_collocate_density.mod base_hooks.mod cp_fm_diag.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/molecular_states.F molecular_states.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:02:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"molecular_states.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' molecular_states.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'molecular_states.mod' due to: molecular_states.o /build/reproducible-path/cp2k-8.1/src/molecular_states.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod cp_realspace_grid_cube.mod qs_collocate_density.mod base_hooks.mod cp_fm_diag.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_loc_molecules.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_loc_molecules.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod molecule_types.mod qs_loc_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod molecule_kind_types.mod message_passing.mod cp_log_handling.mod kinds.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_loc_molecules.F qs_loc_molecules.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:02:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_molecules.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_molecules.F90 +/build/reproducible-path/cp2k-8.1/src/qs_loc_molecules.F:172:60: - 581 | DO imo = mos(roks_low)%mo_set%homo + 1, mos(roks_high)%mo_set%homo - | ^ -Warning: 'roks_high' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_chargemol.mod' due to: qs_chargemol.o /build/reproducible-path/cp2k-8.1/src/qs_chargemol.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_subsys_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod qs_force_types.mod qs_energy_types.mod cp_files.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod orbital_symbols.mod periodic_table.mod cp_log_handling.mod base_hooks.mod orbital_transformation_matrices.mod machine.mod orbital_pointers.mod + 172 | i = molecule_set(imol_now)%lmi(ispin)%nstates + | ^ +Warning: 'imol_now' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_loc_molecules.mod' due to: qs_loc_molecules.o /build/reproducible-path/cp2k-8.1/src/qs_loc_molecules.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod molecule_types.mod qs_loc_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod molecule_kind_types.mod message_passing.mod cp_log_handling.mod kinds.mod memory_utilities.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'wannier_states.o' due to: /build/reproducible-path/cp2k-8.1/src/wannier_states.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod wannier_states_types.mod cp_fm_types.mod input_section_types.mod cp_units.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/wannier_states.F wannier_states.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:02:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"wannier_states.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' wannier_states.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'wannier_states.mod' due to: wannier_states.o /build/reproducible-path/cp2k-8.1/src/wannier_states.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod wannier_states_types.mod cp_fm_types.mod input_section_types.mod cp_units.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_loc_states.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_loc_states.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod molecule_types.mod particle_list_types.mod qs_loc_types.mod cp_fm_types.mod qs_environment_types.mod wannier_states_types.mod pw_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_loc_methods.mod cp_output_handling.mod molecular_moments.mod molecular_dipoles.mod cp_array_utils.mod molecular_states.mod base_hooks.mod qs_loc_molecules.mod wannier_states.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_loc_states.F qs_loc_states.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:02:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_loc_states.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_loc_states.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_loc_states.mod' due to: qs_loc_states.o /build/reproducible-path/cp2k-8.1/src/qs_loc_states.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod molecule_types.mod particle_list_types.mod qs_loc_types.mod cp_fm_types.mod qs_environment_types.mod wannier_states_types.mod pw_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_loc_methods.mod cp_output_handling.mod molecular_moments.mod molecular_dipoles.mod cp_array_utils.mod molecular_states.mod base_hooks.mod qs_loc_molecules.mod wannier_states.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'voronoi_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/voronoi_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_rho_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod physcon.mod bibliography.mod message_passing.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/voronoi_interface.F voronoi_interface.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:02:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"voronoi_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' voronoi_interface.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'voronoi_interface.mod' due to: voronoi_interface.o /build/reproducible-path/cp2k-8.1/src/voronoi_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_rho_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod physcon.mod bibliography.mod message_passing.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_post_gpw.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_post_gpw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cp_control_types.mod qs_scf_types.mod input_section_types.mod molecule_types.mod qs_rho_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod scf_control_types.mod preconditioner_types.mod qs_ks_types.mod pw_types.mod qs_subsys_types.mod et_coupling_types.mod qs_loc_types.mod particle_list_types.mod atomic_kind_types.mod qs_energy_types.mod qs_kind_types.mod hirshfeld_types.mod qs_rho0_types.mod pw_env_types.mod qs_rho_atom_types.mod ps_implicit_types.mod cp_fm_types.mod stm_images.mod mathconstants.mod pw_grids.mod qs_commutators.mod qs_wannier90.mod qs_epr_hyp.mod molden_utils.mod qs_pdos.mod qs_elf_methods.mod mao_wfn_analysis.mod qs_collocate_density.mod memory_utilities.mod voronoi_interface.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod qs_moments.mod atom_kind_orbitals.mod qs_dos.mod qs_ot_eigensolver.mod pw_methods.mod lapack.mod qs_ks_methods.mod cp_fm_diag.mod qs_loc_states.mod qs_mo_io.mod cp_fm_vect.mod pw_poisson_methods.mod qs_active_space_methods.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_array_utils.mod s_square_methods.mod qs_integral_utils.mod qs_grid_atom.mod qs_local_properties.mod hirshfeld_methods.mod cp_realspace_grid_cube.mod qs_mo_methods.mod minbas_wfn_analysis.mod orbital_pointers.mod mulliken.mod qs_core_energies.mod cp_fm_struct.mod kinds.mod cp_ddapc_util.mod physcon.mod qs_electric_field_gradient.mod message_passing.mod qs_loc_dipole.mod ai_onecenter.mod xray_diffraction.mod qs_loc_utils.mod qs_energy_window.mod qs_scf_wfn_mix.mod input_constants.mod transport.mod cp_blacs_env.mod qs_scf_csr_write.mod population_analyses.mod dct.mod admm_utils.mod qs_resp.mod cp_dbcsr_output.mod qs_chargemol.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mao_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/mao_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_ks_types.mod cp_control_types.mod qs_kind_types.mod atomic_kind_types.mod particle_types.mod qs_rho_types.mod kinds.mod base_hooks.mod qs_neighbor_lists.mod qs_overlap.mod particle_methods.mod mao_methods.mod mao_optimizer.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mao_basis.F mao_basis.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:02:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_basis.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mao_basis.mod' due to: mao_basis.o /build/reproducible-path/cp2k-8.1/src/mao_basis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_ks_types.mod cp_control_types.mod qs_kind_types.mod atomic_kind_types.mod particle_types.mod qs_rho_types.mod kinds.mod base_hooks.mod qs_neighbor_lists.mod qs_overlap.mod particle_methods.mod mao_methods.mod mao_optimizer.mod cp_dbcsr_operations.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'minbas_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/minbas_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_mo_types.mod cp_fm_types.mod qs_environment_types.mod qs_kind_types.mod cp_control_types.mod kinds.mod cp_gemm_interface.mod mao_basis.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod lapack.mod particle_methods.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/minbas_methods.F minbas_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:02:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minbas_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minbas_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'minbas_methods.mod' due to: minbas_methods.o /build/reproducible-path/cp2k-8.1/src/minbas_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_mo_types.mod cp_fm_types.mod qs_environment_types.mod qs_kind_types.mod cp_control_types.mod kinds.mod cp_gemm_interface.mod mao_basis.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod lapack.mod particle_methods.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'minbas_wfn_analysis.o' due to: /build/reproducible-path/cp2k-8.1/src/minbas_wfn_analysis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_mo_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod atomic_charges.mod cp_output_handling.mod cp_fm_struct.mod minbas_methods.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod cp_realspace_grid_cube.mod qs_mo_methods.mod mulliken.mod qs_collocate_density.mod cp_fm_basic_linalg.mod iterate_matrix.mod particle_methods.mod cp_blacs_env.mod molden_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/minbas_wfn_analysis.F minbas_wfn_analysis.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:02:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minbas_wfn_analysis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minbas_wfn_analysis.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'minbas_wfn_analysis.mod' due to: minbas_wfn_analysis.o /build/reproducible-path/cp2k-8.1/src/minbas_wfn_analysis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_mo_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod atomic_charges.mod cp_output_handling.mod cp_fm_struct.mod minbas_methods.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod cp_realspace_grid_cube.mod qs_mo_methods.mod mulliken.mod qs_collocate_density.mod cp_fm_basic_linalg.mod iterate_matrix.mod particle_methods.mod cp_blacs_env.mod molden_utils.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xray_diffraction.o' due to: /build/reproducible-path/cp2k-8.1/src/xray_diffraction.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod qs_rho_atom_types.mod kinds.mod pw_grids.mod orbital_transformation_matrices.mod physcon.mod bibliography.mod message_passing.mod memory_utilities.mod util.mod orbital_pointers.mod pw_methods.mod base_hooks.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xray_diffraction.F xray_diffraction.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:02:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xray_diffraction.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xray_diffraction.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xray_diffraction.mod' due to: xray_diffraction.o /build/reproducible-path/cp2k-8.1/src/xray_diffraction.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod paw_proj_set_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod qs_rho_atom_types.mod kinds.mod pw_grids.mod orbital_transformation_matrices.mod physcon.mod bibliography.mod message_passing.mod memory_utilities.mod util.mod orbital_pointers.mod pw_methods.mod base_hooks.mod mathconstants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_post_gpw.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_post_gpw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod cell_types.mod pw_poisson_types.mod ps_implicit_types.mod particle_list_types.mod pw_env_types.mod qs_rho0_types.mod cp_control_types.mod qs_ks_types.mod scf_control_types.mod particle_types.mod qs_scf_types.mod qs_subsys_types.mod preconditioner_types.mod pw_pool_types.mod qs_mo_types.mod admm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_rho_atom_types.mod hirshfeld_types.mod qs_rho_types.mod molecule_types.mod qs_loc_types.mod cp_fm_types.mod basis_set_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod et_coupling_types.mod qs_energy_types.mod qs_ot_eigensolver.mod qs_active_space_methods.mod cp_output_handling.mod qs_wannier90.mod qs_mo_methods.mod cp_dbcsr_output.mod qs_grid_atom.mod qs_scf_wfn_mix.mod lapack.mod orbital_pointers.mod pw_methods.mod qs_chargemol.mod atom_kind_orbitals.mod qs_pdos.mod admm_utils.mod s_square_methods.mod qs_energy_window.mod qs_electric_field_gradient.mod qs_moments.mod cp_ddapc_util.mod qs_commutators.mod mulliken.mod pw_poisson_methods.mod qs_local_properties.mod qs_ks_methods.mod qs_core_energies.mod cp_array_utils.mod qs_loc_utils.mod qs_loc_dipole.mod molden_utils.mod stm_images.mod mathconstants.mod qs_mo_io.mod input_constants.mod mao_wfn_analysis.mod kinds.mod cp_fm_vect.mod population_analyses.mod message_passing.mod cp_realspace_grid_cube.mod qs_integral_utils.mod qs_collocate_density.mod memory_utilities.mod cp_blacs_env.mod qs_scf_csr_write.mod cp_fm_diag.mod qs_resp.mod qs_dos.mod cp_log_handling.mod pw_grids.mod physcon.mod qs_epr_hyp.mod cp_fm_struct.mod qs_mo_occupation.mod cp_dbcsr_operations.mod qs_loc_states.mod ai_onecenter.mod hirshfeld_methods.mod dct.mod voronoi_interface.mod minbas_wfn_analysis.mod transport.mod xray_diffraction.mod base_hooks.mod qs_elf_methods.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_post_gpw.F qs_scf_post_gpw.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:57:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_post_gpw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_post_gpw.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:02:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_post_gpw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_post_gpw.F90 /build/reproducible-path/cp2k-8.1/src/qs_scf_post_gpw.F:673:13: 673 | IF (compute_lumos) THEN | ^ Warning: 'compute_lumos' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_post_gpw.mod' due to: qs_scf_post_gpw.o /build/reproducible-path/cp2k-8.1/src/qs_scf_post_gpw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_neighbor_list_types.mod qs_environment_types.mod cp_control_types.mod qs_scf_types.mod input_section_types.mod molecule_types.mod qs_rho_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod scf_control_types.mod preconditioner_types.mod qs_ks_types.mod pw_types.mod qs_subsys_types.mod et_coupling_types.mod qs_loc_types.mod particle_list_types.mod atomic_kind_types.mod qs_energy_types.mod qs_kind_types.mod hirshfeld_types.mod qs_rho0_types.mod pw_env_types.mod qs_rho_atom_types.mod ps_implicit_types.mod cp_fm_types.mod stm_images.mod mathconstants.mod pw_grids.mod qs_commutators.mod qs_wannier90.mod qs_epr_hyp.mod molden_utils.mod qs_pdos.mod qs_elf_methods.mod mao_wfn_analysis.mod qs_collocate_density.mod memory_utilities.mod voronoi_interface.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod qs_moments.mod atom_kind_orbitals.mod qs_dos.mod qs_ot_eigensolver.mod pw_methods.mod lapack.mod qs_ks_methods.mod cp_fm_diag.mod qs_loc_states.mod qs_mo_io.mod cp_fm_vect.mod pw_poisson_methods.mod qs_active_space_methods.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_array_utils.mod s_square_methods.mod qs_integral_utils.mod qs_grid_atom.mod qs_local_properties.mod hirshfeld_methods.mod cp_realspace_grid_cube.mod qs_mo_methods.mod minbas_wfn_analysis.mod orbital_pointers.mod mulliken.mod qs_core_energies.mod cp_fm_struct.mod kinds.mod cp_ddapc_util.mod physcon.mod qs_electric_field_gradient.mod message_passing.mod qs_loc_dipole.mod ai_onecenter.mod xray_diffraction.mod qs_loc_utils.mod qs_energy_window.mod qs_scf_wfn_mix.mod input_constants.mod transport.mod cp_blacs_env.mod qs_scf_csr_write.mod population_analyses.mod dct.mod admm_utils.mod qs_resp.mod cp_dbcsr_output.mod qs_chargemol.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_post_gpw.mod' due to: qs_scf_post_gpw.o /build/reproducible-path/cp2k-8.1/src/qs_scf_post_gpw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod cell_types.mod pw_poisson_types.mod ps_implicit_types.mod particle_list_types.mod pw_env_types.mod qs_rho0_types.mod cp_control_types.mod qs_ks_types.mod scf_control_types.mod particle_types.mod qs_scf_types.mod qs_subsys_types.mod preconditioner_types.mod pw_pool_types.mod qs_mo_types.mod admm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_rho_atom_types.mod hirshfeld_types.mod qs_rho_types.mod molecule_types.mod qs_loc_types.mod cp_fm_types.mod basis_set_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod et_coupling_types.mod qs_energy_types.mod qs_ot_eigensolver.mod qs_active_space_methods.mod cp_output_handling.mod qs_wannier90.mod qs_mo_methods.mod cp_dbcsr_output.mod qs_grid_atom.mod qs_scf_wfn_mix.mod lapack.mod orbital_pointers.mod pw_methods.mod qs_chargemol.mod atom_kind_orbitals.mod qs_pdos.mod admm_utils.mod s_square_methods.mod qs_energy_window.mod qs_electric_field_gradient.mod qs_moments.mod cp_ddapc_util.mod qs_commutators.mod mulliken.mod pw_poisson_methods.mod qs_local_properties.mod qs_ks_methods.mod qs_core_energies.mod cp_array_utils.mod qs_loc_utils.mod qs_loc_dipole.mod molden_utils.mod stm_images.mod mathconstants.mod qs_mo_io.mod input_constants.mod mao_wfn_analysis.mod kinds.mod cp_fm_vect.mod population_analyses.mod message_passing.mod cp_realspace_grid_cube.mod qs_integral_utils.mod qs_collocate_density.mod memory_utilities.mod cp_blacs_env.mod qs_scf_csr_write.mod cp_fm_diag.mod qs_resp.mod qs_dos.mod cp_log_handling.mod pw_grids.mod physcon.mod qs_epr_hyp.mod cp_fm_struct.mod qs_mo_occupation.mod cp_dbcsr_operations.mod qs_loc_states.mod ai_onecenter.mod hirshfeld_methods.mod dct.mod voronoi_interface.mod minbas_wfn_analysis.mod transport.mod xray_diffraction.mod base_hooks.mod qs_elf_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_post_se.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_post_se.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_subsys_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod particle_list_types.mod semi_empirical_types.mod atomic_kind_types.mod cp_result_types.mod input_section_types.mod qs_ks_types.mod ai_moments.mod mathconstants.mod qs_ks_methods.mod cp_result_methods.mod kinds.mod qs_mo_io.mod cp_output_handling.mod physcon.mod moments_utils.mod message_passing.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_band_structure.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_band_structure.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod scf_control_types.mod cp_fm_pool_types.mod cell_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_gamma2kp.mod physcon.mod message_passing.mod qs_matrix_pools.mod string_utilities.mod cp_para_env.mod cp_files.mod cp_blacs_env.mod machine.mod base_hooks.mod mathconstants.mod qs_scf_diagonalization.mod kpoint_methods.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_band_structure.F qs_band_structure.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:02:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_band_structure.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_band_structure.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_band_structure.mod' due to: qs_band_structure.o /build/reproducible-path/cp2k-8.1/src/qs_band_structure.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod scf_control_types.mod cp_fm_pool_types.mod cell_types.mod qs_mo_types.mod qs_scf_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_gamma2kp.mod physcon.mod message_passing.mod qs_matrix_pools.mod string_utilities.mod cp_para_env.mod cp_files.mod cp_blacs_env.mod machine.mod base_hooks.mod mathconstants.mod qs_scf_diagonalization.mod kpoint_methods.mod cp_parser_methods.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_post_se.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_post_se.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod qs_ks_types.mod cp_result_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod physcon.mod ai_moments.mod message_passing.mod cp_dbcsr_output.mod moments_utils.mod qs_ks_methods.mod cp_result_methods.mod orbital_pointers.mod base_hooks.mod mathconstants.mod qs_mo_io.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_post_se.F qs_scf_post_se.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:57:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_post_se.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_post_se.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_post_se.mod' due to: qs_scf_post_se.o /build/reproducible-path/cp2k-8.1/src/qs_scf_post_se.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_subsys_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod particle_list_types.mod semi_empirical_types.mod atomic_kind_types.mod cp_result_types.mod input_section_types.mod qs_ks_types.mod ai_moments.mod mathconstants.mod qs_ks_methods.mod cp_result_methods.mod kinds.mod qs_mo_io.mod cp_output_handling.mod physcon.mod moments_utils.mod message_passing.mod cp_log_handling.mod cp_dbcsr_output.mod base_hooks.mod orbital_pointers.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:02:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_post_se.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_post_se.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_post_se.mod' due to: qs_scf_post_se.o /build/reproducible-path/cp2k-8.1/src/qs_scf_post_se.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod semi_empirical_types.mod qs_ks_types.mod cp_result_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod physcon.mod ai_moments.mod message_passing.mod cp_dbcsr_output.mod moments_utils.mod qs_ks_methods.mod cp_result_methods.mod orbital_pointers.mod base_hooks.mod mathconstants.mod qs_mo_io.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_band_structure.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_band_structure.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_scf_types.mod cp_fm_types.mod scf_control_types.mod input_section_types.mod string_utilities.mod mathconstants.mod cp_blacs_env.mod cp_files.mod qs_matrix_pools.mod kinds.mod kpoint_methods.mod physcon.mod cp_parser_methods.mod message_passing.mod cp_para_env.mod qs_gamma2kp.mod qs_scf_diagonalization.mod cp_log_handling.mod base_hooks.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_band_structure.F qs_band_structure.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:57:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_band_structure.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_band_structure.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_band_structure.mod' due to: qs_band_structure.o /build/reproducible-path/cp2k-8.1/src/qs_band_structure.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_scf_types.mod cp_fm_types.mod scf_control_types.mod input_section_types.mod string_utilities.mod mathconstants.mod cp_blacs_env.mod cp_files.mod qs_matrix_pools.mod kinds.mod kpoint_methods.mod physcon.mod cp_parser_methods.mod message_passing.mod cp_para_env.mod qs_gamma2kp.mod qs_scf_diagonalization.mod cp_log_handling.mod base_hooks.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'localization_tb.o' due to: /build/reproducible-path/cp2k-8.1/src/localization_tb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod qs_mo_types.mod particle_list_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_fm_vect.mod qs_loc_states.mod cp_array_utils.mod qs_loc_utils.mod qs_loc_dipole.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/localization_tb.F localization_tb.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:03:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"localization_tb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' localization_tb.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'localization_tb.mod' due to: localization_tb.o /build/reproducible-path/cp2k-8.1/src/localization_tb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod qs_mo_types.mod particle_list_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_fm_vect.mod qs_loc_states.mod cp_array_utils.mod qs_loc_utils.mod qs_loc_dipole.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_optimize_ri_basis_types.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_optimize_ri_basis_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod mathconstants.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_optimize_ri_basis_types.F lri_optimize_ri_basis_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:03:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_optimize_ri_basis_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_optimize_ri_basis_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_optimize_ri_basis_types.mod' due to: lri_optimize_ri_basis_types.o /build/reproducible-path/cp2k-8.1/src/lri_optimize_ri_basis_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod mathconstants.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'lri_optimize_ri_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/lri_optimize_ri_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod lri_optimize_ri_basis_types.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod input_section_types.mod lri_environment_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod message_passing.mod memory_utilities.mod generic_os_integrals.mod lri_environment_methods.mod base_hooks.mod lri_environment_init.mod input_constants.mod powell.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/lri_optimize_ri_basis.F lri_optimize_ri_basis.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:03:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"lri_optimize_ri_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' lri_optimize_ri_basis.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'lri_optimize_ri_basis.mod' due to: lri_optimize_ri_basis.o /build/reproducible-path/cp2k-8.1/src/lri_optimize_ri_basis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod lri_optimize_ri_basis_types.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod input_section_types.mod lri_environment_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod message_passing.mod memory_utilities.mod generic_os_integrals.mod lri_environment_methods.mod base_hooks.mod lri_environment_init.mod input_constants.mod powell.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_post_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_post_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_scf_types.mod qs_environment_types.mod cp_control_types.mod localization_tb.mod basis_set_output.mod base_hooks.mod lri_optimize_ri_basis.mod qs_scf_post_tb.mod qs_scf_post_gpw.mod qs_scf_post_se.mod qs_band_structure.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_post_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_post_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_scf_types.mod cp_control_types.mod input_section_types.mod qs_scf_post_tb.mod basis_set_output.mod qs_scf_post_gpw.mod qs_band_structure.mod qs_scf_post_se.mod localization_tb.mod lri_optimize_ri_basis.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_post_scf.F qs_scf_post_scf.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:57:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_post_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_post_scf.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_post_scf.mod' due to: qs_scf_post_scf.o /build/reproducible-path/cp2k-8.1/src/qs_scf_post_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod qs_scf_types.mod qs_environment_types.mod cp_control_types.mod localization_tb.mod basis_set_output.mod base_hooks.mod lri_optimize_ri_basis.mod qs_scf_post_tb.mod qs_scf_post_gpw.mod qs_scf_post_se.mod qs_band_structure.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:03:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_post_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_post_scf.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_post_scf.mod' due to: qs_scf_post_scf.o /build/reproducible-path/cp2k-8.1/src/qs_scf_post_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_scf_types.mod cp_control_types.mod input_section_types.mod qs_scf_post_tb.mod basis_set_output.mod qs_scf_post_gpw.mod qs_band_structure.mod qs_scf_post_se.mod localization_tb.mod lri_optimize_ri_basis.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod cp_para_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod qs_scf_types.mod qs_density_mixing_types.mod cp_fm_types.mod atomic_kind_types.mod qs_charges_types.mod scf_control_types.mod cp_result_types.mod input_section_types.mod qs_block_davidson_types.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod qs_ks_methods.mod base_hooks.mod cp_files.mod qs_rho_methods.mod cp_result_methods.mod kinds.mod qs_mo_io.mod qs_scf_initialization.mod qs_scf_output.mod qs_scf_loop_utils.mod preconditioner.mod qs_integrate_potential.mod cp_output_handling.mod cp_dbcsr_operations.mod kpoint_io.mod qs_outer_scf.mod message_passing.mod qs_cdft_scf_utils.mod qs_ot.mod qs_wf_history_methods.mod qs_diis.mod mathlib.mod cp_log_handling.mod qs_mo_occupation.mod qs_scf_post_scf.mod qs_ot_scf.mod qs_mo_methods.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf.F qs_scf.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:57:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf.F90 -/build/reproducible-path/cp2k-8.1/src/qs_scf.F:1588:31: - - 1588 | alpha = alpha_ls - | ^ -Warning: 'alpha_ls' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_scf.F:282:59: - - 282 | scf_control%outer_scf%have_scf = outer_scf_loop - | ^ -Warning: 'outer_scf_loop' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_scf.F:281:45: - - 281 | scf_control%max_scf = max_scf_tmp - | ^ -Warning: 'max_scf_tmp' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf.mod' due to: qs_scf.o /build/reproducible-path/cp2k-8.1/src/qs_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod cp_para_types.mod qs_cdft_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod qs_scf_types.mod qs_density_mixing_types.mod cp_fm_types.mod atomic_kind_types.mod qs_charges_types.mod scf_control_types.mod cp_result_types.mod input_section_types.mod qs_block_davidson_types.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod qs_ks_methods.mod base_hooks.mod cp_files.mod qs_rho_methods.mod cp_result_methods.mod kinds.mod qs_mo_io.mod qs_scf_initialization.mod qs_scf_output.mod qs_scf_loop_utils.mod preconditioner.mod qs_integrate_potential.mod cp_output_handling.mod cp_dbcsr_operations.mod kpoint_io.mod qs_outer_scf.mod message_passing.mod qs_cdft_scf_utils.mod qs_ot.mod qs_wf_history_methods.mod qs_diis.mod mathlib.mod cp_log_handling.mod qs_mo_occupation.mod qs_scf_post_scf.mod qs_ot_scf.mod qs_mo_methods.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagation_forces.o' due to: /build/reproducible-path/cp2k-8.1/src/rt_propagation_forces.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod particle_types.mod qs_force_types.mod qs_mo_types.mod admm_types.mod rt_propagation_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_control_types.mod kinds.mod cp_fm_vect.mod cp_gemm_interface.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod base_hooks.mod mathconstants.mod qs_overlap.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rt_propagation_forces.F rt_propagation_forces.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:03:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rt_propagation_forces.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_forces.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagation_forces.mod' due to: rt_propagation_forces.o /build/reproducible-path/cp2k-8.1/src/rt_propagation_forces.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod particle_types.mod qs_force_types.mod qs_mo_types.mod admm_types.mod rt_propagation_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_control_types.mod kinds.mod cp_fm_vect.mod cp_gemm_interface.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod base_hooks.mod mathconstants.mod qs_overlap.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_chebyshev.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod input_section_types.mod qs_environment_types.mod arnoldi_api.mod cp_log_handling.mod mathconstants.mod base_hooks.mod dm_ls_scf_qs.mod cp_output_handling.mod machine.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F dm_ls_chebyshev.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:57:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_chebyshev.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_chebyshev.F90 -/build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F:370:100: - - 370 | gdensity(igrid, iwindow) = kernel_g(1)*aitchev_T(1, iwindow) + 2.0_dp*dummy2(iwindow) - | ^ -Warning: 'aitchev_t.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F:370:100: Warning: 'aitchev_t.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F:355:72: - - 355 | chev_Es_dos(igrid) = (chev_E(igrid) - interval_b)/interval_a - | ^ -Warning: 'interval_b' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F:355:72: Warning: 'interval_a' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_chebyshev.mod' due to: dm_ls_chebyshev.o /build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod input_section_types.mod qs_environment_types.mod arnoldi_api.mod cp_log_handling.mod mathconstants.mod base_hooks.mod dm_ls_scf_qs.mod cp_output_handling.mod machine.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xtb_ehess.o' due to: /build/reproducible-path/cp2k-8.1/src/xtb_ehess.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod atprop_types.mod xtb_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod distribution_1d_types.mod virial_types.mod ewald_pw_types.mod cp_control_types.mod ewald_methods_tb.mod kinds.mod message_passing.mod base_hooks.mod mathconstants.mod xtb_coulomb.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xtb_ehess.F xtb_ehess.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:03:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xtb_ehess.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xtb_ehess.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xtb_ehess.mod' due to: xtb_ehess.o /build/reproducible-path/cp2k-8.1/src/xtb_ehess.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod atprop_types.mod xtb_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod distribution_1d_types.mod virial_types.mod ewald_pw_types.mod cp_control_types.mod ewald_methods_tb.mod kinds.mod message_passing.mod base_hooks.mod mathconstants.mod xtb_coulomb.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_curvy.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_curvy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod input_constants.mod mathlib.mod cp_log_handling.mod mathconstants.mod base_hooks.mod iterate_matrix.mod bibliography.mod machine.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_curvy.F dm_ls_scf_curvy.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:58:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_curvy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_curvy.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_curvy.mod' due to: dm_ls_scf_curvy.o /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_curvy.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod input_constants.mod mathlib.mod cp_log_handling.mod mathconstants.mod base_hooks.mod iterate_matrix.mod bibliography.mod machine.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod qs_loc_types.mod xtb_types.mod cp_fm_types.mod qs_p_env_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod task_list_types.mod qs_kpp1_env_types.mod pw_types.mod qs_kind_types.mod xc_rho_set_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod kg_environment_types.mod lri_environment_types.mod qs_vxc_atom.mod cp_log_handling.mod kinds.mod cp_fm_vect.mod cp_gemm_interface.mod qs_integrate_potential.mod cp_output_handling.mod qs_loc_methods.mod qs_rho0_ggrid.mod qs_rho_methods.mod qs_ks_atom.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_external_control.mod lri_ks_methods.mod mulliken.mod hartree_local_methods.mod pw_poisson_methods.mod qs_collocate_density.mod string_utilities.mod xtb_ehess.mod cp_fm_basic_linalg.mod preconditioner.mod cp_files.mod pw_methods.mod qs_loc_utils.mod xc.mod xc_derivatives.mod qs_gapw_densities.mod machine.mod base_hooks.mod kg_correction.mod input_constants.mod hfx_energy_potential.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_methods.F qs_linres_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:03:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_methods.mod' due to: qs_linres_methods.o /build/reproducible-path/cp2k-8.1/src/qs_linres_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod qs_loc_types.mod xtb_types.mod cp_fm_types.mod qs_p_env_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod task_list_types.mod qs_kpp1_env_types.mod pw_types.mod qs_kind_types.mod xc_rho_set_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod kg_environment_types.mod lri_environment_types.mod qs_vxc_atom.mod cp_log_handling.mod kinds.mod cp_fm_vect.mod cp_gemm_interface.mod qs_integrate_potential.mod cp_output_handling.mod qs_loc_methods.mod qs_rho0_ggrid.mod qs_rho_methods.mod qs_ks_atom.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_external_control.mod lri_ks_methods.mod mulliken.mod hartree_local_methods.mod pw_poisson_methods.mod qs_collocate_density.mod string_utilities.mod xtb_ehess.mod cp_fm_basic_linalg.mod preconditioner.mod cp_files.mod pw_methods.mod qs_loc_utils.mod xc.mod xc_derivatives.mod qs_gapw_densities.mod machine.mod base_hooks.mod kg_correction.mod input_constants.mod hfx_energy_potential.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 transport_env_types.mod dm_ls_scf_types.mod qs_environment_types.mod cp_control_types.mod qs_diis_types.mod input_section_types.mod qs_ks_types.mod molecule_types.mod input_constants.mod arnoldi_api.mod qs_scf_post_gpw.mod dm_ls_chebyshev.mod pexsi_methods.mod dm_ls_scf_qs.mod transport.mod kinds.mod dm_ls_scf_curvy.mod qs_scf_post_tb.mod cp_external_control.mod dm_ls_scf_methods.mod iterate_matrix.mod pao_main.mod bibliography.mod qs_diis.mod mathlib.mod cp_log_handling.mod base_hooks.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dm_ls_scf.F dm_ls_scf.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:58:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf.F90 -/build/reproducible-path/cp2k-8.1/src/dm_ls_scf.F:631:63: - - 631 | extra_scf = maxscf_reached .OR. scf_converged - | ^ -Warning: 'scf_converged' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/dm_ls_scf.F:631:63: Warning: 'maxscf_reached' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_scf.mod' due to: dm_ls_scf.o /build/reproducible-path/cp2k-8.1/src/dm_ls_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 transport_env_types.mod dm_ls_scf_types.mod qs_environment_types.mod cp_control_types.mod qs_diis_types.mod input_section_types.mod qs_ks_types.mod molecule_types.mod input_constants.mod arnoldi_api.mod qs_scf_post_gpw.mod dm_ls_chebyshev.mod pexsi_methods.mod dm_ls_scf_qs.mod transport.mod kinds.mod dm_ls_scf_curvy.mod qs_scf_post_tb.mod cp_external_control.mod dm_ls_scf_methods.mod iterate_matrix.mod pao_main.mod bibliography.mod qs_diis.mod mathlib.mod cp_log_handling.mod base_hooks.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_kpp1_env_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_kpp1_env_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_rho_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod xc_derivative_set_types.mod qs_p_env_types.mod qs_environment_types.mod pw_env_types.mod qs_kpp1_env_types.mod pw_types.mod xc_rho_set_types.mod input_section_types.mod qs_energy_types.mod qs_vxc_atom.mod cp_log_handling.mod kinds.mod qs_integrate_potential.mod cp_output_handling.mod qs_rho0_ggrid.mod qs_ks_atom.mod cp_dbcsr_operations.mod kahan_sum.mod hartree_local_methods.mod pw_poisson_methods.mod qs_ks_methods.mod pw_methods.mod xc.mod xc_derivatives.mod qs_gapw_densities.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_kpp1_env_methods.F qs_kpp1_env_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:03:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_kpp1_env_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_kpp1_env_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_kpp1_env_methods.mod' due to: qs_kpp1_env_methods.o /build/reproducible-path/cp2k-8.1/src/qs_kpp1_env_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_rho_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod xc_derivative_set_types.mod qs_p_env_types.mod qs_environment_types.mod pw_env_types.mod qs_kpp1_env_types.mod pw_types.mod xc_rho_set_types.mod input_section_types.mod qs_energy_types.mod qs_vxc_atom.mod cp_log_handling.mod kinds.mod qs_integrate_potential.mod cp_output_handling.mod qs_rho0_ggrid.mod qs_ks_atom.mod cp_dbcsr_operations.mod kahan_sum.mod hartree_local_methods.mod pw_poisson_methods.mod qs_ks_methods.mod pw_methods.mod xc.mod xc_derivatives.mod qs_gapw_densities.mod base_hooks.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_p_env_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_p_env_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod qs_ks_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_mo_types.mod cp_fm_types.mod qs_p_env_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod qs_kpp1_env_types.mod hartree_local_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod qs_rho0_methods.mod cp_fm_vect.mod cp_gemm_interface.mod cp_output_handling.mod qs_rho0_ggrid.mod qs_rho_methods.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_matrix_pools.mod hartree_local_methods.mod cp_fm_cholesky.mod string_utilities.mod qs_ks_methods.mod cp_fm_basic_linalg.mod qs_rho_atom_methods.mod cp_blacs_env.mod base_hooks.mod qs_kpp1_env_methods.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_p_env_methods.F qs_p_env_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:03:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_p_env_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_p_env_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_p_env_methods.mod' due to: qs_p_env_methods.o /build/reproducible-path/cp2k-8.1/src/qs_p_env_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod qs_ks_types.mod cp_fm_pool_types.mod qs_rho_types.mod qs_mo_types.mod cp_fm_types.mod qs_p_env_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod qs_kpp1_env_types.mod hartree_local_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod qs_rho0_methods.mod cp_fm_vect.mod cp_gemm_interface.mod cp_output_handling.mod qs_rho0_ggrid.mod qs_rho_methods.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_matrix_pools.mod hartree_local_methods.mod cp_fm_cholesky.mod string_utilities.mod qs_ks_methods.mod cp_fm_basic_linalg.mod qs_rho_atom_methods.mod cp_blacs_env.mod base_hooks.mod qs_kpp1_env_methods.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'response_solver.o' due to: /build/reproducible-path/cp2k-8.1/src/response_solver.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod xc_derivative_set_types.mod cp_fm_types.mod qs_p_env_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod xc_rho_set_types.mod qs_linres_types.mod input_section_types.mod virial_types.mod cp_control_types.mod kg_environment_types.mod cp_log_handling.mod qs_kinetic.mod kinds.mod cp_gemm_interface.mod qs_integrate_potential.mod qs_linres_methods.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod core_ppnl.mod pw_poisson_methods.mod hfx_derivatives.mod qs_collocate_density.mod qs_p_env_methods.mod qs_vxc.mod qs_ks_methods.mod qs_core_energies.mod kg_tnadd_mat.mod pw_methods.mod xc.mod cp_blacs_env.mod xc_derivatives.mod base_hooks.mod kg_correction.mod core_ppl.mod qs_overlap.mod input_constants.mod hfx_energy_potential.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/response_solver.F response_solver.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:04:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"response_solver.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' response_solver.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'response_solver.mod' due to: response_solver.o /build/reproducible-path/cp2k-8.1/src/response_solver.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod xc_derivative_set_types.mod cp_fm_types.mod qs_p_env_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod xc_rho_set_types.mod qs_linres_types.mod input_section_types.mod virial_types.mod cp_control_types.mod kg_environment_types.mod cp_log_handling.mod qs_kinetic.mod kinds.mod cp_gemm_interface.mod qs_integrate_potential.mod qs_linres_methods.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod core_ppnl.mod pw_poisson_methods.mod hfx_derivatives.mod qs_collocate_density.mod qs_p_env_methods.mod qs_vxc.mod qs_ks_methods.mod qs_core_energies.mod kg_tnadd_mat.mod pw_methods.mod xc.mod cp_blacs_env.mod xc_derivatives.mod base_hooks.mod kg_correction.mod core_ppl.mod qs_overlap.mod input_constants.mod hfx_energy_potential.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ec_efield_local.o' due to: /build/reproducible-path/cp2k-8.1/src/ec_efield_local.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_force_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_period_efield_types.mod cp_control_types.mod qs_energy_types.mod ec_env_types.mod kinds.mod qs_moments.mod ai_moments.mod orbital_pointers.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ec_efield_local.F ec_efield_local.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:04:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ec_efield_local.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ec_efield_local.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ec_efield_local.mod' due to: ec_efield_local.o /build/reproducible-path/cp2k-8.1/src/ec_efield_local.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_force_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_period_efield_types.mod cp_control_types.mod qs_energy_types.mod ec_env_types.mod kinds.mod qs_moments.mod ai_moments.mod orbital_pointers.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'energy_corrections.o' due to: /build/reproducible-path/cp2k-8.1/src/energy_corrections.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_mo_types.mod qs_rho_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod molecule_types.mod xc_derivative_set_types.mod cp_fm_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod external_potential_types.mod pw_types.mod qs_kind_types.mod xc_rho_set_types.mod distribution_1d_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod ec_env_types.mod task_list_types.mod cp_log_handling.mod qs_kinetic.mod kinds.mod qs_integrate_potential.mod physcon.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod mao_basis.mod cp_fm_struct.mod qs_moments.mod cp_dbcsr_operations.mod message_passing.mod core_ppnl.mod response_solver.mod qs_neighbor_lists.mod pw_poisson_methods.mod cp_fm_cholesky.mod task_list_methods.mod qs_collocate_density.mod moments_utils.mod qs_vxc.mod dm_ls_scf_methods.mod qs_ks_methods.mod cp_fm_basic_linalg.mod qs_core_energies.mod iterate_matrix.mod pw_methods.mod xc.mod cp_blacs_env.mod qs_dispersion_pairpot.mod xc_derivatives.mod base_hooks.mod core_ppl.mod cp_fm_diag.mod qs_overlap.mod input_constants.mod ec_efield_local.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/energy_corrections.F energy_corrections.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:04:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"energy_corrections.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' energy_corrections.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'energy_corrections.mod' due to: energy_corrections.o /build/reproducible-path/cp2k-8.1/src/energy_corrections.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_force_types.mod qs_mo_types.mod qs_rho_types.mod xc_rho_cflags_types.mod pw_poisson_types.mod molecule_types.mod xc_derivative_set_types.mod cp_fm_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod external_potential_types.mod pw_types.mod qs_kind_types.mod xc_rho_set_types.mod distribution_1d_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod ec_env_types.mod task_list_types.mod cp_log_handling.mod qs_kinetic.mod kinds.mod qs_integrate_potential.mod physcon.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod mao_basis.mod cp_fm_struct.mod qs_moments.mod cp_dbcsr_operations.mod message_passing.mod core_ppnl.mod response_solver.mod qs_neighbor_lists.mod pw_poisson_methods.mod cp_fm_cholesky.mod task_list_methods.mod qs_collocate_density.mod moments_utils.mod qs_vxc.mod dm_ls_scf_methods.mod qs_ks_methods.mod cp_fm_basic_linalg.mod qs_core_energies.mod iterate_matrix.mod pw_methods.mod xc.mod cp_blacs_env.mod qs_dispersion_pairpot.mod xc_derivatives.mod base_hooks.mod core_ppl.mod cp_fm_diag.mod qs_overlap.mod input_constants.mod ec_efield_local.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'domain_submatrix_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/domain_submatrix_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 domain_submatrix_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'domain_submatrix_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/domain_submatrix_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 domain_submatrix_types.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/domain_submatrix_methods.F domain_submatrix_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:58:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"domain_submatrix_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' domain_submatrix_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:04:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"domain_submatrix_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' domain_submatrix_methods.F90 /build/reproducible-path/cp2k-8.1/src/domain_submatrix_methods.F:771:31: 771 | SUBROUTINE trace_submatrices(A, B, trace) | ^ Warning: 'trace_submatrices' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'domain_submatrix_methods.mod' due to: domain_submatrix_methods.o /build/reproducible-path/cp2k-8.1/src/domain_submatrix_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 domain_submatrix_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'domain_submatrix_methods.mod' due to: domain_submatrix_methods.o /build/reproducible-path/cp2k-8.1/src/domain_submatrix_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 domain_submatrix_types.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_lbfgs_types.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_lbfgs_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_log_handling.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/almo_scf_lbfgs_types.F almo_scf_lbfgs_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:04:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_lbfgs_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_lbfgs_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_lbfgs_types.mod' due to: almo_scf_lbfgs_types.o /build/reproducible-path/cp2k-8.1/src/almo_scf_lbfgs_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_log_handling.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ct_types.o' due to: /build/reproducible-path/cp2k-8.1/src/ct_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kinds.mod base_hooks.mod input_constants.mod cp_blacs_env.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ct_types.F ct_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:04:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ct_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ct_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ct_types.mod' due to: ct_types.o /build/reproducible-path/cp2k-8.1/src/ct_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kinds.mod base_hooks.mod input_constants.mod cp_blacs_env.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_diis_types.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_diis_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 domain_submatrix_types.mod cp_log_handling.mod kinds.mod base_hooks.mod domain_submatrix_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/almo_scf_diis_types.F almo_scf_diis_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:04:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_diis_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_diis_types.F90 +/build/reproducible-path/cp2k-8.1/src/almo_scf_diis_types.F:516:41: + + 516 | almo_scf_diis_error_overlap = trace + | ^ +Warning: 'trace' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/almo_scf_diis_types.F:516:41: Warning: 'trace' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/almo_scf_diis_types.F:317:75: + + 317 | diis_env%m_b(idomain)%mdata(in_point + 1, irow + 1) = trace0 + | ^ +Warning: 'trace0' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_diis_types.mod' due to: almo_scf_diis_types.o /build/reproducible-path/cp2k-8.1/src/almo_scf_diis_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 domain_submatrix_types.mod cp_log_handling.mod kinds.mod base_hooks.mod domain_submatrix_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod cp_para_types.mod domain_submatrix_types.mod input_constants.mod mathlib.mod cp_log_handling.mod base_hooks.mod fermi_utils.mod iterate_matrix.mod cp_dbcsr_cholesky.mod bibliography.mod domain_submatrix_methods.mod cp_blacs_env.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ct_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/ct_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ct_types.mod cp_dbcsr_cholesky.mod cp_log_handling.mod kinds.mod iterate_matrix.mod base_hooks.mod input_constants.mod machine.mod cp_dbcsr_diag.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ct_methods.F ct_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:04:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ct_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ct_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ct_methods.mod' due to: ct_methods.o /build/reproducible-path/cp2k-8.1/src/ct_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ct_types.mod cp_dbcsr_cholesky.mod cp_log_handling.mod kinds.mod iterate_matrix.mod base_hooks.mod input_constants.mod machine.mod cp_dbcsr_diag.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod domain_submatrix_types.mod almo_scf_types.mod mathlib.mod util.mod cp_dbcsr_cholesky.mod cp_log_handling.mod kinds.mod iterate_matrix.mod base_hooks.mod fermi_utils.mod input_constants.mod cp_blacs_env.mod domain_submatrix_methods.mod bibliography.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/almo_scf_methods.F almo_scf_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:58:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:04:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_methods.F90 /build/reproducible-path/cp2k-8.1/src/almo_scf_methods.F:3034:33: 3034 | SUBROUTINE pseudo_matrix_power(A, Apow, power, N, range1, range1_thr, shift) @@ -45720,37 +45224,11 @@ 2928 | IF (use_both) THEN | ^ Warning: 'use_both' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_methods.mod' due to: almo_scf_methods.o /build/reproducible-path/cp2k-8.1/src/almo_scf_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 almo_scf_types.mod cp_para_types.mod domain_submatrix_types.mod input_constants.mod mathlib.mod cp_log_handling.mod base_hooks.mod fermi_utils.mod iterate_matrix.mod cp_dbcsr_cholesky.mod bibliography.mod domain_submatrix_methods.mod cp_blacs_env.mod util.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_diis_types.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_diis_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 domain_submatrix_types.mod cp_log_handling.mod base_hooks.mod domain_submatrix_methods.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/almo_scf_diis_types.F almo_scf_diis_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:59:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_diis_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_diis_types.F90 -/build/reproducible-path/cp2k-8.1/src/almo_scf_diis_types.F:516:41: - - 516 | almo_scf_diis_error_overlap = trace - | ^ -Warning: 'trace' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/almo_scf_diis_types.F:516:41: Warning: 'trace' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/almo_scf_diis_types.F:317:75: - - 317 | diis_env%m_b(idomain)%mdata(in_point + 1, irow + 1) = trace0 - | ^ -Warning: 'trace0' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_diis_types.mod' due to: almo_scf_diis_types.o /build/reproducible-path/cp2k-8.1/src/almo_scf_diis_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 domain_submatrix_types.mod cp_log_handling.mod base_hooks.mod domain_submatrix_methods.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_lbfgs_types.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_lbfgs_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_log_handling.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/almo_scf_lbfgs_types.F almo_scf_lbfgs_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:59:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_lbfgs_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_lbfgs_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_lbfgs_types.mod' due to: almo_scf_lbfgs_types.o /build/reproducible-path/cp2k-8.1/src/almo_scf_lbfgs_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_log_handling.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ct_types.o' due to: /build/reproducible-path/cp2k-8.1/src/ct_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_constants.mod base_hooks.mod cp_blacs_env.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ct_types.F ct_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:59:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ct_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ct_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ct_types.mod' due to: ct_types.o /build/reproducible-path/cp2k-8.1/src/ct_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_constants.mod base_hooks.mod cp_blacs_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_methods.mod' due to: almo_scf_methods.o /build/reproducible-path/cp2k-8.1/src/almo_scf_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod domain_submatrix_types.mod almo_scf_types.mod mathlib.mod util.mod cp_dbcsr_cholesky.mod cp_log_handling.mod kinds.mod iterate_matrix.mod base_hooks.mod fermi_utils.mod input_constants.mod cp_blacs_env.mod domain_submatrix_methods.mod bibliography.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_qs.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_qs.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod almo_scf_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_ks_types.mod molecule_types.mod qs_energy_types.mod input_constants.mod qs_ks_methods.mod cp_fm_struct.mod qs_rho_methods.mod kinds.mod cp_dbcsr_operations.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_log_handling.mod base_hooks.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_qs.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_qs.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod almo_scf_types.mod qs_scf_types.mod molecule_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod cp_dbcsr_cp2k_link.mod qs_rho_methods.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_ks_methods.mod base_hooks.mod input_constants.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/almo_scf_qs.F almo_scf_qs.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:59:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_qs.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_qs.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:05:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_qs.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_qs.F90 /build/reproducible-path/cp2k-8.1/src/almo_scf_qs.F:248:47: 248 | ALLOCATE (distr_new_array(nlength)) @@ -45776,16 +45254,11 @@ 1301 | rcov=contact1_radius) | ^ Warning: 'contact_atom_1' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_qs.mod' due to: almo_scf_qs.o /build/reproducible-path/cp2k-8.1/src/almo_scf_qs.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod almo_scf_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_ks_types.mod molecule_types.mod qs_energy_types.mod input_constants.mod qs_ks_methods.mod cp_fm_struct.mod qs_rho_methods.mod kinds.mod cp_dbcsr_operations.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_log_handling.mod base_hooks.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ct_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/ct_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ct_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod iterate_matrix.mod cp_dbcsr_cholesky.mod machine.mod cp_dbcsr_diag.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ct_methods.F ct_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:59:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ct_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ct_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ct_methods.mod' due to: ct_methods.o /build/reproducible-path/cp2k-8.1/src/ct_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 ct_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod iterate_matrix.mod cp_dbcsr_cholesky.mod machine.mod cp_dbcsr_diag.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_qs.mod' due to: almo_scf_qs.o /build/reproducible-path/cp2k-8.1/src/almo_scf_qs.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod almo_scf_types.mod qs_scf_types.mod molecule_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod cp_dbcsr_cp2k_link.mod qs_rho_methods.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_ks_methods.mod base_hooks.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_optimizer.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_optimizer.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 almo_scf_diis_types.mod almo_scf_lbfgs_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod almo_scf_types.mod domain_submatrix_types.mod ct_types.mod input_section_types.mod qs_energy_types.mod input_constants.mod almo_scf_methods.mod cp_blacs_env.mod cp_files.mod kinds.mod cp_external_control.mod cp_output_handling.mod message_passing.mod iterate_matrix.mod cp_dbcsr_cholesky.mod almo_scf_qs.mod ct_methods.mod particle_methods.mod cp_log_handling.mod base_hooks.mod qs_localization_methods.mod qs_loc_utils.mod domain_submatrix_methods.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf_optimizer.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf_optimizer.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod almo_scf_types.mod qs_environment_types.mod qs_kind_types.mod domain_submatrix_types.mod input_section_types.mod almo_scf_lbfgs_types.mod ct_types.mod qs_energy_types.mod almo_scf_diis_types.mod ct_methods.mod cp_log_handling.mod kinds.mod cp_output_handling.mod domain_submatrix_methods.mod message_passing.mod cp_external_control.mod qs_localization_methods.mod cp_dbcsr_cholesky.mod cp_files.mod almo_scf_methods.mod iterate_matrix.mod qs_loc_utils.mod almo_scf_qs.mod particle_methods.mod cp_blacs_env.mod machine.mod base_hooks.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/almo_scf_optimizer.F almo_scf_optimizer.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 04:59:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_optimizer.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_optimizer.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:05:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf_optimizer.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf_optimizer.F90 /build/reproducible-path/cp2k-8.1/src/almo_scf_optimizer.F:3218:25: 3218 | SUBROUTINE split_v_blk(almo_scf_env) @@ -45845,16 +45318,450 @@ 1829 | appr_sec_der = 2.0*((e1 - e0)/step_size - g0)/step_size | ^ Warning: 'e0' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_optimizer.mod' due to: almo_scf_optimizer.o /build/reproducible-path/cp2k-8.1/src/almo_scf_optimizer.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 almo_scf_diis_types.mod almo_scf_lbfgs_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod almo_scf_types.mod domain_submatrix_types.mod ct_types.mod input_section_types.mod qs_energy_types.mod input_constants.mod almo_scf_methods.mod cp_blacs_env.mod cp_files.mod kinds.mod cp_external_control.mod cp_output_handling.mod message_passing.mod iterate_matrix.mod cp_dbcsr_cholesky.mod almo_scf_qs.mod ct_methods.mod particle_methods.mod cp_log_handling.mod base_hooks.mod qs_localization_methods.mod qs_loc_utils.mod domain_submatrix_methods.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf_optimizer.mod' due to: almo_scf_optimizer.o /build/reproducible-path/cp2k-8.1/src/almo_scf_optimizer.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod almo_scf_types.mod qs_environment_types.mod qs_kind_types.mod domain_submatrix_types.mod input_section_types.mod almo_scf_lbfgs_types.mod ct_types.mod qs_energy_types.mod almo_scf_diis_types.mod ct_methods.mod cp_log_handling.mod kinds.mod cp_output_handling.mod domain_submatrix_methods.mod message_passing.mod cp_external_control.mod qs_localization_methods.mod cp_dbcsr_cholesky.mod cp_files.mod almo_scf_methods.mod iterate_matrix.mod qs_loc_utils.mod almo_scf_qs.mod particle_methods.mod cp_blacs_env.mod machine.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod mscfg_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod almo_scf_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod input_constants.mod almo_scf_methods.mod cp_blacs_env.mod cp_dbcsr_diag.mod kinds.mod almo_scf_optimizer.mod cp_dbcsr_operations.mod message_passing.mod iterate_matrix.mod almo_scf_qs.mod bibliography.mod cp_para_env.mod mathlib.mod cp_log_handling.mod qs_scf_post_scf.mod base_hooks.mod qs_initial_guess.mod domain_submatrix_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'almo_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/almo_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mscfg_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod almo_scf_types.mod qs_scf_types.mod molecule_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_scf_post_scf.mod cp_log_handling.mod kinds.mod domain_submatrix_methods.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod qs_initial_guess.mod cp_para_env.mod cp_dbcsr_diag.mod mathlib.mod almo_scf_optimizer.mod almo_scf_methods.mod iterate_matrix.mod almo_scf_qs.mod cp_blacs_env.mod base_hooks.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/almo_scf.F almo_scf.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:00:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf.mod' due to: almo_scf.o /build/reproducible-path/cp2k-8.1/src/almo_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod mscfg_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod almo_scf_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod input_constants.mod almo_scf_methods.mod cp_blacs_env.mod cp_dbcsr_diag.mod kinds.mod almo_scf_optimizer.mod cp_dbcsr_operations.mod message_passing.mod iterate_matrix.mod almo_scf_qs.mod bibliography.mod cp_para_env.mod mathlib.mod cp_log_handling.mod qs_scf_post_scf.mod base_hooks.mod qs_initial_guess.mod domain_submatrix_methods.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:05:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"almo_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' almo_scf.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'almo_scf.mod' due to: almo_scf.o /build/reproducible-path/cp2k-8.1/src/almo_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mscfg_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod almo_scf_types.mod qs_scf_types.mod molecule_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_scf_post_scf.mod cp_log_handling.mod kinds.mod domain_submatrix_methods.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod qs_initial_guess.mod cp_para_env.mod cp_dbcsr_diag.mod mathlib.mod almo_scf_optimizer.mod almo_scf_methods.mod iterate_matrix.mod almo_scf_qs.mod cp_blacs_env.mod base_hooks.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'et_coupling_proj.o' due to: /build/reproducible-path/cp2k-8.1/src/et_coupling_proj.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod pw_pool_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_mo_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_output_handling.mod cp_fm_struct.mod qs_mo_occupation.mod bibliography.mod cp_dbcsr_operations.mod cp_realspace_grid_cube.mod qs_mo_methods.mod qs_collocate_density.mod cp_fm_basic_linalg.mod orbital_pointers.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/et_coupling_proj.F et_coupling_proj.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"et_coupling_proj.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' et_coupling_proj.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'et_coupling_proj.mod' due to: et_coupling_proj.o /build/reproducible-path/cp2k-8.1/src/et_coupling_proj.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod pw_pool_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_mo_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_output_handling.mod cp_fm_struct.mod qs_mo_occupation.mod bibliography.mod cp_dbcsr_operations.mod cp_realspace_grid_cube.mod qs_mo_methods.mod qs_collocate_density.mod cp_fm_basic_linalg.mod orbital_pointers.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_ot_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_ot_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod qs_ot_types.mod cp_fm_types.mod qs_mo_types.mod input_section_types.mod qs_ot.mod cp_log_handling.mod cp_array_utils.mod kinds.mod base_hooks.mod cp_output_handling.mod qs_ot_minimizer.mod qs_mo_occupation.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_ot_scf.F qs_ot_scf.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_ot_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_ot_scf.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_ot_scf.mod' due to: qs_ot_scf.o /build/reproducible-path/cp2k-8.1/src/qs_ot_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 scf_control_types.mod qs_ot_types.mod cp_fm_types.mod qs_mo_types.mod input_section_types.mod qs_ot.mod cp_log_handling.mod cp_array_utils.mod kinds.mod base_hooks.mod cp_output_handling.mod qs_ot_minimizer.mod qs_mo_occupation.mod cp_dbcsr_operations.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf_loop_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf_loop_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod scf_control_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod qs_environment_types.mod input_section_types.mod qs_density_mixing_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod qs_fb_env_methods.mod kinds.mod qs_mixing_utils.mod qs_mom_methods.mod qs_rho_methods.mod qs_mo_occupation.mod cp_external_control.mod qs_mo_methods.mod qs_scf_output.mod base_hooks.mod qs_scf_diagonalization.mod qs_gspace_mixing.mod qs_scf_methods.mod qs_outer_scf.mod qs_ot_scf.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf_loop_utils.F qs_scf_loop_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf_loop_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf_loop_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf_loop_utils.mod' due to: qs_scf_loop_utils.o /build/reproducible-path/cp2k-8.1/src/qs_scf_loop_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod qs_ks_types.mod scf_control_types.mod qs_rho_types.mod qs_mo_types.mod qs_scf_types.mod qs_environment_types.mod input_section_types.mod qs_density_mixing_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod qs_fb_env_methods.mod kinds.mod qs_mixing_utils.mod qs_mom_methods.mod qs_rho_methods.mod qs_mo_occupation.mod cp_external_control.mod qs_mo_methods.mod qs_scf_output.mod base_hooks.mod qs_scf_diagonalization.mod qs_gspace_mixing.mod qs_scf_methods.mod qs_outer_scf.mod qs_ot_scf.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_cdft_scf_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_cdft_scf_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_scf_types.mod cp_control_types.mod scf_control_types.mod mathlib.mod cp_log_handling.mod cp_files.mod kinds.mod input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_cdft_scf_utils.F qs_cdft_scf_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_cdft_scf_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_cdft_scf_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_cdft_scf_utils.mod' due to: qs_cdft_scf_utils.o /build/reproducible-path/cp2k-8.1/src/qs_cdft_scf_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod qs_scf_types.mod cp_control_types.mod scf_control_types.mod mathlib.mod cp_log_handling.mod cp_files.mod kinds.mod input_constants.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod pw_pool_types.mod qs_ks_types.mod cp_result_types.mod scf_control_types.mod particle_types.mod qs_cdft_types.mod qs_charges_types.mod qs_mo_types.mod qs_rho_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_block_davidson_types.mod pw_env_types.mod qs_kind_types.mod input_section_types.mod qs_density_mixing_types.mod cp_control_types.mod qs_energy_types.mod qs_scf_post_scf.mod cp_log_handling.mod kinds.mod qs_integrate_potential.mod cp_output_handling.mod qs_wf_history_methods.mod qs_rho_methods.mod qs_mo_occupation.mod qs_scf_loop_utils.mod cp_dbcsr_operations.mod message_passing.mod qs_mo_methods.mod kpoint_io.mod qs_ks_methods.mod preconditioner.mod mathlib.mod cp_result_methods.mod qs_ot.mod cp_files.mod qs_diis.mod qs_scf_output.mod machine.mod base_hooks.mod qs_cdft_scf_utils.mod qs_mo_io.mod input_constants.mod qs_outer_scf.mod qs_ot_scf.mod qs_scf_initialization.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_scf.F qs_scf.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_scf.F90 +/build/reproducible-path/cp2k-8.1/src/qs_scf.F:1588:31: + + 1588 | alpha = alpha_ls + | ^ +Warning: 'alpha_ls' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_scf.F:282:59: + + 282 | scf_control%outer_scf%have_scf = outer_scf_loop + | ^ +Warning: 'outer_scf_loop' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_scf.F:281:45: + + 281 | scf_control%max_scf = max_scf_tmp + | ^ +Warning: 'max_scf_tmp' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_scf.mod' due to: qs_scf.o /build/reproducible-path/cp2k-8.1/src/qs_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod pw_pool_types.mod qs_ks_types.mod cp_result_types.mod scf_control_types.mod particle_types.mod qs_cdft_types.mod qs_charges_types.mod qs_mo_types.mod qs_rho_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_block_davidson_types.mod pw_env_types.mod qs_kind_types.mod input_section_types.mod qs_density_mixing_types.mod cp_control_types.mod qs_energy_types.mod qs_scf_post_scf.mod cp_log_handling.mod kinds.mod qs_integrate_potential.mod cp_output_handling.mod qs_wf_history_methods.mod qs_rho_methods.mod qs_mo_occupation.mod qs_scf_loop_utils.mod cp_dbcsr_operations.mod message_passing.mod qs_mo_methods.mod kpoint_io.mod qs_ks_methods.mod preconditioner.mod mathlib.mod cp_result_methods.mod qs_ot.mod cp_files.mod qs_diis.mod qs_scf_output.mod machine.mod base_hooks.mod qs_cdft_scf_utils.mod qs_mo_io.mod input_constants.mod qs_outer_scf.mod qs_ot_scf.mod qs_scf_initialization.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_issc_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_issc_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_mo_types.mod cp_fm_types.mod qs_p_env_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_fermi_contact.mod physcon.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod qs_linres_methods.mod qs_spin_orbit.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod memory_utilities.mod qs_elec_field.mod mathlib.mod particle_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_issc_utils.F qs_linres_issc_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:24 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_issc_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_issc_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_issc_utils.mod' due to: qs_linres_issc_utils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_issc_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_mo_types.mod cp_fm_types.mod qs_p_env_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_fermi_contact.mod physcon.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod qs_linres_methods.mod qs_spin_orbit.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod memory_utilities.mod qs_elec_field.mod mathlib.mod particle_methods.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_epr_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod qs_rho_atom_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod qs_matrix_pools.mod base_hooks.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_utils.F qs_linres_epr_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_epr_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_epr_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_epr_utils.mod' due to: qs_linres_epr_utils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod qs_rho_atom_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod qs_matrix_pools.mod base_hooks.mod mathconstants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_nmr_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pw_env_types.mod qs_linres_types.mod cp_control_types.mod scf_control_types.mod particle_types.mod cell_types.mod cp_parser_types.mod input_section_types.mod atomic_kind_types.mod cp_units.mod cp_log_handling.mod kinds.mod qs_matrix_pools.mod base_hooks.mod cp_output_handling.mod memory_utilities.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_utils.F qs_linres_nmr_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_nmr_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_nmr_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_nmr_utils.mod' due to: qs_linres_nmr_utils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod pw_env_types.mod qs_linres_types.mod cp_control_types.mod scf_control_types.mod particle_types.mod cell_types.mod cp_parser_types.mod input_section_types.mod atomic_kind_types.mod cp_units.mod cp_log_handling.mod kinds.mod qs_matrix_pools.mod base_hooks.mod cp_output_handling.mod memory_utilities.mod cp_parser_methods.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_current_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_current_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod qs_loc_types.mod cp_fm_types.mod qs_p_env_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod realspace_grid_types.mod qs_linres_op.mod cp_log_handling.mod kinds.mod qs_loc_methods.mod qs_linres_methods.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod memory_utilities.mod cp_array_utils.mod qs_operators_ao.mod pw_methods.mod particle_methods.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_current_utils.F qs_linres_current_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_current_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_current_utils.F90 +/build/reproducible-path/cp2k-8.1/src/qs_linres_current_utils.F:1152:56: + + 1152 | state_done(idir, istate_next) = .TRUE. + | ^ +Warning: 'istate_next' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_current_utils.mod' due to: qs_linres_current_utils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_current_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_rho_types.mod qs_mo_types.mod qs_loc_types.mod cp_fm_types.mod qs_p_env_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod realspace_grid_types.mod qs_linres_op.mod cp_log_handling.mod kinds.mod qs_loc_methods.mod qs_linres_methods.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod memory_utilities.mod cp_array_utils.mod qs_operators_ao.mod pw_methods.mod particle_methods.mod base_hooks.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_nmr_epr_common_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_epr_common_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod pw_types.mod cell_types.mod mathconstants.mod kinds.mod pw_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_epr_common_utils.F qs_linres_nmr_epr_common_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:37 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_nmr_epr_common_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_nmr_epr_common_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_nmr_epr_common_utils.mod' due to: qs_linres_nmr_epr_common_utils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_epr_common_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_grid_types.mod pw_pool_types.mod pw_types.mod cell_types.mod mathconstants.mod kinds.mod pw_methods.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_nmr_shift.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_shift.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod realspace_grid_types.mod qs_linres_op.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qs_harmonics_atom.mod message_passing.mod qs_grid_atom.mod mathlib.mod util.mod pw_methods.mod base_hooks.mod qs_linres_nmr_epr_common_utils.mod mathconstants.mod pw_spline_utils.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_shift.F qs_linres_nmr_shift.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:37 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_nmr_shift.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_nmr_shift.F90 +/build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_shift.F:267:70: + + 267 | n_nics, na, natom, natom_local, natom_tot, nkind, nnics_local, nr, nra, nspins, num_pe, & + | ^ +Warning: 'nnics_local' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_nmr_shift.mod' due to: qs_linres_nmr_shift.o /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_shift.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_grid_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod realspace_grid_types.mod qs_linres_op.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qs_harmonics_atom.mod message_passing.mod qs_grid_atom.mod mathlib.mod util.mod pw_methods.mod base_hooks.mod qs_linres_nmr_epr_common_utils.mod mathconstants.mod pw_spline_utils.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_epr_nablavks.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_nablavks.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_rho_types.mod pw_poisson_types.mod particle_list_types.mod qs_oce_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod qs_rho0_types.mod external_potential_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_vxc_atom.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qs_harmonics_atom.mod cp_realspace_grid_cube.mod hartree_local_methods.mod pw_poisson_methods.mod qs_vxc.mod qs_grid_atom.mod qs_ks_methods.mod util.mod qs_rho_atom_methods.mod pw_methods.mod qs_gapw_densities.mod base_hooks.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_nablavks.F qs_linres_epr_nablavks.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_epr_nablavks.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_epr_nablavks.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_epr_nablavks.mod' due to: qs_linres_epr_nablavks.o /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_nablavks.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_rho_types.mod pw_poisson_types.mod particle_list_types.mod qs_oce_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod qs_rho0_types.mod external_potential_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_vxc_atom.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qs_harmonics_atom.mod cp_realspace_grid_cube.mod hartree_local_methods.mod pw_poisson_methods.mod qs_vxc.mod qs_grid_atom.mod qs_ks_methods.mod util.mod qs_rho_atom_methods.mod pw_methods.mod qs_gapw_densities.mod base_hooks.mod mathconstants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_epr_ownutils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_ownutils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod qs_rho_atom_types.mod realspace_grid_types.mod qs_linres_op.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qs_harmonics_atom.mod message_passing.mod qs_grid_atom.mod mathlib.mod qs_core_energies.mod util.mod pw_methods.mod base_hooks.mod qs_linres_nmr_epr_common_utils.mod pw_spline_utils.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_ownutils.F qs_linres_epr_ownutils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_epr_ownutils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_epr_ownutils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_epr_ownutils.mod' due to: qs_linres_epr_ownutils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_ownutils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod qs_rho_atom_types.mod realspace_grid_types.mod qs_linres_op.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qs_harmonics_atom.mod message_passing.mod qs_grid_atom.mod mathlib.mod qs_core_energies.mod util.mod pw_methods.mod base_hooks.mod qs_linres_nmr_epr_common_utils.mod pw_spline_utils.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_polar_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_polar_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_result_types.mod cell_types.mod qs_mo_types.mod force_env_types.mod cp_fm_types.mod qs_p_env_types.mod qs_environment_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod physcon.mod qs_linres_methods.mod cp_fm_struct.mod bibliography.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_result_methods.mod machine.mod base_hooks.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_polar_utils.F qs_linres_polar_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_polar_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_polar_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_polar_utils.mod' due to: qs_linres_polar_utils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_polar_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_result_types.mod cell_types.mod qs_mo_types.mod force_env_types.mod cp_fm_types.mod qs_p_env_types.mod qs_environment_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod physcon.mod qs_linres_methods.mod cp_fm_struct.mod bibliography.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod cp_result_methods.mod machine.mod base_hooks.mod mathconstants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_module.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_module.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod force_env_types.mod qs_p_env_types.mod qs_environment_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod qs_linres_issc_utils.mod cp_log_handling.mod qs_linres_op.mod qs_linres_methods.mod cp_output_handling.mod qs_rho_methods.mod qs_linres_epr_utils.mod qs_linres_nmr_utils.mod bibliography.mod qs_mo_methods.mod qs_linres_current.mod qs_p_env_methods.mod qs_linres_current_utils.mod qs_linres_nmr_shift.mod qs_linres_epr_nablavks.mod qs_linres_epr_ownutils.mod base_hooks.mod qs_linres_polar_utils.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_module.F qs_linres_module.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_module.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_module.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_module.mod' due to: qs_linres_module.o /build/reproducible-path/cp2k-8.1/src/qs_linres_module.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_mo_types.mod force_env_types.mod qs_p_env_types.mod qs_environment_types.mod qs_linres_types.mod input_section_types.mod cp_control_types.mod qs_linres_issc_utils.mod cp_log_handling.mod qs_linres_op.mod qs_linres_methods.mod cp_output_handling.mod qs_rho_methods.mod qs_linres_epr_utils.mod qs_linres_nmr_utils.mod bibliography.mod qs_mo_methods.mod qs_linres_current.mod qs_p_env_methods.mod qs_linres_current_utils.mod qs_linres_nmr_shift.mod qs_linres_epr_nablavks.mod qs_linres_epr_ownutils.mod base_hooks.mod qs_linres_polar_utils.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_loc_types.mod qs_ot_types.mod cp_fm_types.mod distribution_2d_types.mod input_section_types.mod kinds.mod physcon.mod qs_harmonics_atom.mod libint_wrapper.mod cp_para_env.mod qs_grid_atom.mod memory_utilities.mod mathlib.mod libint_2c_3c.mod cp_files.mod cp_array_utils.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_types.F xas_tdp_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_types.mod' due to: xas_tdp_types.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_loc_types.mod qs_ot_types.mod cp_fm_types.mod distribution_2d_types.mod input_section_types.mod kinds.mod physcon.mod qs_harmonics_atom.mod libint_wrapper.mod cp_para_env.mod qs_grid_atom.mod memory_utilities.mod mathlib.mod libint_2c_3c.mod cp_files.mod cp_array_utils.mod base_hooks.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod xas_tdp_types.mod qs_o3c_types.mod eri_mme_types.mod kinds.mod ai_contraction_sphi.mod gamma.mod cp_dbcsr_operations.mod message_passing.mod libint_wrapper.mod qs_neighbor_lists.mod qs_integral_utils.mod t_c_g0.mod constants_operator.mod mathlib.mod cp_eri_mme_interface.mod libint_2c_3c.mod cp_array_utils.mod cp_files.mod orbital_pointers.mod particle_methods.mod cp_blacs_env.mod generic_os_integrals.mod base_hooks.mod eri_mme_integrate.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_integrals.F xas_tdp_integrals.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:06:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_integrals.F90 +/build/reproducible-path/cp2k-8.1/src/xas_tdp_integrals.F:486:96: + + 486 | !$OMP iabc,sabc,jset,kset,ncob,ncoc,sgfb,sgfc,egfb,egfc,sabc_ext,cpp_buffer,ccp_buffer) + | ^ +Warning: 'my_eps_screen' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_integrals.mod' due to: xas_tdp_integrals.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod xas_tdp_types.mod qs_o3c_types.mod eri_mme_types.mod kinds.mod ai_contraction_sphi.mod gamma.mod cp_dbcsr_operations.mod message_passing.mod libint_wrapper.mod qs_neighbor_lists.mod qs_integral_utils.mod t_c_g0.mod constants_operator.mod mathlib.mod cp_eri_mme_interface.mod libint_2c_3c.mod cp_array_utils.mod cp_files.mod orbital_pointers.mod particle_methods.mod cp_blacs_env.mod generic_os_integrals.mod base_hooks.mod eri_mme_integrate.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_rho_types.mod xc_rho_cflags_types.mod xc_derivative_set_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod xas_tdp_types.mod cp_control_types.mod cp_log_handling.mod xas_tdp_integrals.mod kinds.mod orbital_transformation_matrices.mod ai_contraction_sphi.mod spherical_harmonics.mod physcon.mod cp_dbcsr_operations.mod message_passing.mod qs_harmonics_atom.mod qs_integral_utils.mod cp_para_env.mod qs_grid_atom.mod memory_utilities.mod mathlib.mod util.mod cp_dbcsr_cholesky.mod libint_2c_3c.mod cp_array_utils.mod orbital_pointers.mod xc.mod lebedev.mod particle_methods.mod cp_blacs_env.mod xc_derivatives.mod base_hooks.mod atom_operators.mod mathconstants.mod xc_atom.mod qs_overlap.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F xas_tdp_atom.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:07:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_atom.F90 +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:414:58: + + 414 | grid_atom%rad(1:new_nr) = grid_atom%rad(first_ir:nr) + | ^ +Warning: 'first_ir' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:396:68: + + 396 | INTEGER :: first_ir, ir, llmax_p1, na, new_nr, nr + | ^ +note: 'first_ir' was declared here +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1132:63: + + 1132 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: dso + | ^ +Warning: 'dso.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:70: + + 1133 | REAL(dp), DIMENSION(:, :), POINTER :: dgr1, dgr2, ga, gr, ri_sphi_so, zet + | ^ +Warning: 'dgr2.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:70: Warning: 'dgr2.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:70: Warning: 'dgr2.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:70: Warning: 'dgr2.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:70: Warning: 'dgr2.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1228:85: + + 1228 | dgr2(:, iso_proc:iso_proc), nr, 1.0_dp, dso(:, :, dir), na) + | ^ +Warning: 'dgr2.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:64: + + 1133 | REAL(dp), DIMENSION(:, :), POINTER :: dgr1, dgr2, ga, gr, ri_sphi_so, zet + | ^ +Warning: 'dgr1.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:64: Warning: 'dgr1.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:64: Warning: 'dgr1.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:64: Warning: 'dgr1.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:64: Warning: 'dgr1.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1226:85: + + 1226 | dgr1(:, iso_proc:iso_proc), nr, 0.0_dp, dso(:, :, dir), na) + | ^ +Warning: 'dgr1.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: + + 1134 | REAL(dp), DIMENSION(:, :, :), POINTER :: dga1, dga2, rhoa, rhob + | ^ +Warning: 'dga2.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: 'dga2.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: 'dga2.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: 'dga2.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: 'dga2.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: 'dga2.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: 'dga2.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: + + 1134 | REAL(dp), DIMENSION(:, :, :), POINTER :: dga1, dga2, rhoa, rhob + | ^ +Warning: 'dga1.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: 'dga1.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: 'dga1.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: 'dga1.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: 'dga1.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: 'dga1.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: 'dga1.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1315:68: + + 1315 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: co, dsgf, pos + | ^ +Warning: 'dsgf.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1315:68: Warning: 'dsgf.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1315:68: Warning: 'dsgf.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1315:68: Warning: 'dsgf.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1553:37: + + 1553 | IF (do_gga) dsgf = 0.0_dp + | ^ +Warning: 'dsgf.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1315:68: + + 1315 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: co, dsgf, pos + | ^ +note: 'dsgf.dim[0].ubound' was declared here +/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1315:68: Warning: 'dsgf.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_atom.mod' due to: xas_tdp_atom.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_rho_types.mod xc_rho_cflags_types.mod xc_derivative_set_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod xas_tdp_types.mod cp_control_types.mod cp_log_handling.mod xas_tdp_integrals.mod kinds.mod orbital_transformation_matrices.mod ai_contraction_sphi.mod spherical_harmonics.mod physcon.mod cp_dbcsr_operations.mod message_passing.mod qs_harmonics_atom.mod qs_integral_utils.mod cp_para_env.mod qs_grid_atom.mod memory_utilities.mod mathlib.mod util.mod cp_dbcsr_cholesky.mod libint_2c_3c.mod cp_array_utils.mod orbital_pointers.mod xc.mod lebedev.mod particle_methods.mod cp_blacs_env.mod xc_derivatives.mod base_hooks.mod atom_operators.mod mathconstants.mod xc_atom.mod qs_overlap.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tp_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tp_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod qs_ks_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_charges_types.mod qs_mo_types.mod qs_rho_types.mod qs_scf_types.mod xas_env_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod input_section_types.mod qs_density_mixing_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod qs_ot_eigensolver.mod kinds.mod qs_mixing_utils.mod qs_loc_methods.mod qs_scf.mod cp_output_handling.mod qs_rho_methods.mod qs_mo_occupation.mod message_passing.mod cp_external_control.mod qs_mo_methods.mod xas_restart.mod qs_ks_methods.mod preconditioner.mod cp_array_utils.mod particle_methods.mod cp_blacs_env.mod qs_scf_output.mod machine.mod base_hooks.mod xas_control.mod qs_scf_diagonalization.mod input_constants.mod qs_gspace_mixing.mod qs_scf_methods.mod qs_scf_initialization.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tp_scf.F xas_tp_scf.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:07:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tp_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tp_scf.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tp_scf.mod' due to: xas_tp_scf.o /build/reproducible-path/cp2k-8.1/src/xas_tp_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod qs_ks_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_charges_types.mod qs_mo_types.mod qs_rho_types.mod qs_scf_types.mod xas_env_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod input_section_types.mod qs_density_mixing_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod qs_ot_eigensolver.mod kinds.mod qs_mixing_utils.mod qs_loc_methods.mod qs_scf.mod cp_output_handling.mod qs_rho_methods.mod qs_mo_occupation.mod message_passing.mod cp_external_control.mod qs_mo_methods.mod xas_restart.mod qs_ks_methods.mod preconditioner.mod cp_array_utils.mod particle_methods.mod cp_blacs_env.mod qs_scf_output.mod machine.mod base_hooks.mod xas_control.mod qs_scf_diagonalization.mod input_constants.mod qs_gspace_mixing.mod qs_scf_methods.mod qs_scf_initialization.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_mo_types.mod qs_scf_types.mod xas_env_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_loc_methods.mod cp_gemm_interface.mod qs_scf.mod physcon.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod periodic_table.mod cp_fm_struct.mod ai_overlap.mod cp_dbcsr_operations.mod cp_external_control.mod qs_matrix_pools.mod qs_mo_methods.mod xas_restart.mod ai_contraction.mod memory_utilities.mod cp_array_utils.mod orbital_pointers.mod qs_loc_utils.mod qs_operators_ao.mod particle_methods.mod qs_diis.mod base_hooks.mod xas_control.mod xas_tp_scf.mod qs_mo_io.mod input_constants.mod qs_scf_initialization.mod qs_pdos.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_methods.F xas_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:07:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_methods.mod' due to: xas_methods.o /build/reproducible-path/cp2k-8.1/src/xas_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod scf_control_types.mod particle_types.mod cell_types.mod qs_mo_types.mod qs_scf_types.mod xas_env_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_loc_methods.mod cp_gemm_interface.mod qs_scf.mod physcon.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod periodic_table.mod cp_fm_struct.mod ai_overlap.mod cp_dbcsr_operations.mod cp_external_control.mod qs_matrix_pools.mod qs_mo_methods.mod xas_restart.mod ai_contraction.mod memory_utilities.mod cp_array_utils.mod orbital_pointers.mod qs_loc_utils.mod qs_operators_ao.mod particle_methods.mod qs_diis.mod base_hooks.mod xas_control.mod xas_tp_scf.mod qs_mo_io.mod input_constants.mod qs_scf_initialization.mod qs_pdos.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_kernel.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_kernel.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod cp_para_types.mod basis_set_types.mod qs_environment_types.mod xas_tdp_types.mod qs_kind_types.mod particle_types.mod message_passing.mod util.mod kinds.mod base_hooks.mod qs_integral_utils.mod particle_methods.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_kernel.F xas_tdp_kernel.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:07:29 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_kernel.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_kernel.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_kernel.mod' due to: xas_tdp_kernel.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_kernel.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod cp_para_types.mod basis_set_types.mod qs_environment_types.mod xas_tdp_types.mod qs_kind_types.mod particle_types.mod message_passing.mod util.mod kinds.mod base_hooks.mod qs_integral_utils.mod particle_methods.mod cp_dbcsr_operations.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_correction.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_correction.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_mo_types.mod admm_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod xas_tdp_types.mod cp_cfm_types.mod cp_control_types.mod admm_utils.mod cp_log_handling.mod kinds.mod hfx_admm_utils.mod cp_gemm_interface.mod physcon.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod cp_cfm_diag.mod qs_ks_methods.mod util.mod cp_array_utils.mod cp_blacs_env.mod machine.mod base_hooks.mod xas_tdp_kernel.mod cp_fm_diag.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_correction.F xas_tdp_correction.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:07:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_correction.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_correction.F90 +/build/reproducible-path/cp2k-8.1/src/xas_tdp_correction.F:516:46: + + 516 | nbatch_occ = MAX(1, nblk_occ/batch_size) + | ^ +Warning: 'nblk_occ' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_correction.F:517:48: + + 517 | nbatch_virt = MAX(1, nblk_virt/batch_size) + | ^ +Warning: 'nblk_virt' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_correction.mod' due to: xas_tdp_correction.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_correction.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_mo_types.mod admm_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod xas_tdp_types.mod cp_cfm_types.mod cp_control_types.mod admm_utils.mod cp_log_handling.mod kinds.mod hfx_admm_utils.mod cp_gemm_interface.mod physcon.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod cp_cfm_diag.mod qs_ks_methods.mod util.mod cp_array_utils.mod cp_blacs_env.mod machine.mod base_hooks.mod xas_tdp_kernel.mod cp_fm_diag.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod qs_mo_types.mod cp_fm_types.mod qs_environment_types.mod xas_tdp_types.mod cp_cfm_types.mod cp_log_handling.mod qs_ot_eigensolver.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_cfm_basic_linalg.mod qs_mo_methods.mod cp_cfm_diag.mod cp_fm_basic_linalg.mod cp_dbcsr_diag.mod mathlib.mod cp_dbcsr_cholesky.mod cp_blacs_env.mod base_hooks.mod xas_tdp_kernel.mod cp_fm_diag.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_utils.F xas_tdp_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:08:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_utils.mod' due to: xas_tdp_utils.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod preconditioner_types.mod qs_mo_types.mod cp_fm_types.mod qs_environment_types.mod xas_tdp_types.mod cp_cfm_types.mod cp_log_handling.mod qs_ot_eigensolver.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_cfm_basic_linalg.mod qs_mo_methods.mod cp_cfm_diag.mod cp_fm_basic_linalg.mod cp_dbcsr_diag.mod mathlib.mod cp_dbcsr_cholesky.mod cp_blacs_env.mod base_hooks.mod xas_tdp_kernel.mod cp_fm_diag.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_mo_types.mod admm_types.mod qs_rho_types.mod qs_scf_types.mod parallel_rng_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod xas_tdp_types.mod cp_control_types.mod admm_utils.mod cp_log_handling.mod kinds.mod xas_tdp_integrals.mod qs_loc_methods.mod cp_gemm_interface.mod physcon.mod cp_output_handling.mod qs_interactions.mod periodic_table.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod libint_wrapper.mod qs_mo_methods.mod xc_write_output.mod xas_tdp_atom.mod input_cp2k_dft.mod xas_methods.mod xas_tdp_correction.mod cp_fm_basic_linalg.mod memory_utilities.mod mathlib.mod util.mod cp_files.mod qs_operators_ao.mod qs_loc_utils.mod xas_tdp_utils.mod particle_methods.mod cp_blacs_env.mod machine.mod base_hooks.mod cp_fm_diag.mod input_constants.mod qs_pdos.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F xas_tdp_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:08:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_methods.F90 +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2514:26: + + 2514 | nmo = SIZE(lr_evals) + | ^ +Warning: 'lr_evals.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2514:26: Warning: 'lr_evals.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2443:68: + + 2443 | REAL(dp), DIMENSION(:), POINTER :: lr_evals + | ^ +Warning: 'lr_evals.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2443:68: Warning: 'lr_evals.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2612:33: + + 2612 | IF (nspins == 1 .AND. ndo_mo == 1) THEN + | ^ +Warning: 'nspins' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:1501:41: + + 1501 | ALLOCATE (my_mos(n_states, nspins)) + | ^ +Warning: 'n_states' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2056:27: + + 2056 | nosc = SIZE(lr_evals) + | ^ +Warning: 'lr_evals.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2056:27: Warning: 'lr_evals.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2105:63: + + 2105 | osc_str(:) = pref*2.0_dp/3.0_dp*lr_evals(:)*osc_str(:) + | ^ +Warning: 'lr_evals.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2105:63: Warning: 'lr_evals.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2054:28: + + 2054 | ndo_so = ndo_mo*nspins + | ^ +Warning: 'nspins' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2170:27: + + 2170 | nosc = SIZE(lr_evals) + | ^ +Warning: 'lr_evals.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2170:27: Warning: 'lr_evals.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2229:100: + + 2229 | osc_str(:) = pref*1._dp/20._dp*a_fine**2*lr_evals(:)**3*(osc_str(:) - 1._dp/3._dp*trace(:)**2) + | ^ +Warning: 'lr_evals.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2229:100: Warning: 'lr_evals.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2168:28: + + 2168 | ndo_so = ndo_mo*nspins + | ^ +Warning: 'nspins' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_methods.mod' due to: xas_tdp_methods.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod qs_mo_types.mod admm_types.mod qs_rho_types.mod qs_scf_types.mod parallel_rng_types.mod qs_loc_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod input_section_types.mod xas_tdp_types.mod cp_control_types.mod admm_utils.mod cp_log_handling.mod kinds.mod xas_tdp_integrals.mod qs_loc_methods.mod cp_gemm_interface.mod physcon.mod cp_output_handling.mod qs_interactions.mod periodic_table.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod libint_wrapper.mod qs_mo_methods.mod xc_write_output.mod xas_tdp_atom.mod input_cp2k_dft.mod xas_methods.mod xas_tdp_correction.mod cp_fm_basic_linalg.mod memory_utilities.mod mathlib.mod util.mod cp_files.mod qs_operators_ao.mod qs_loc_utils.mod xas_tdp_utils.mod particle_methods.mod cp_blacs_env.mod machine.mod base_hooks.mod cp_fm_diag.mod input_constants.mod qs_pdos.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_stda_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod cp_control_types.mod qs_kind_types.mod atomic_kind_types.mod cp_log_handling.mod kinds.mod base_hooks.mod physcon.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_types.F qs_tddfpt2_stda_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:08:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_stda_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_stda_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_stda_types.mod' due to: qs_tddfpt2_stda_types.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod basis_set_types.mod cp_control_types.mod qs_kind_types.mod atomic_kind_types.mod cp_log_handling.mod kinds.mod base_hooks.mod physcon.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_subgroups.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod cell_types.mod admm_types.mod molecule_types.mod cp_fm_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod cp_control_types.mod task_list_types.mod kinds.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod pw_env_methods.mod cp_dbcsr_operations.mod message_passing.mod qs_neighbor_lists.mod task_list_methods.mod cp_para_env.mod cp_blacs_env.mod distribution_methods.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F qs_tddfpt2_subgroups.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:08:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_subgroups.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_subgroups.F90 +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: + + 184 | TYPE(mgrid_saved_parameters) :: mgrid_saved + | ^ +Warning: 'mgrid_saved.relative_cutoff' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: Warning: 'mgrid_saved.progression_factor' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:491:44: + + 491 | qs_control%cutoff = mgrid_saved%cutoff + | ^ +Warning: 'mgrid_saved.cutoff' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: + + 184 | TYPE(mgrid_saved_parameters) :: mgrid_saved + | ^ +note: 'mgrid_saved.cutoff' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:490:78: + + 490 | qs_control%skip_load_balance_distributed = mgrid_saved%skip_load_balance + | ^ +Warning: 'MEM [(struct mgrid_saved_parameters *)&mgrid_saved + 8B]' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: + + 184 | TYPE(mgrid_saved_parameters) :: mgrid_saved + | ^ +note: 'MEM [(struct mgrid_saved_parameters *)&mgrid_saved + 8B]' was declared here +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: Warning: 'MEM [(struct mgrid_saved_parameters *)&mgrid_saved + 4B]' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: Warning: 'MEM [(struct mgrid_saved_parameters *)&mgrid_saved]' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_subgroups.mod' due to: qs_tddfpt2_subgroups.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod cell_types.mod admm_types.mod molecule_types.mod cp_fm_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod cp_control_types.mod task_list_types.mod kinds.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod pw_env_methods.mod cp_dbcsr_operations.mod message_passing.mod qs_neighbor_lists.mod task_list_methods.mod cp_para_env.mod cp_blacs_env.mod distribution_methods.mod base_hooks.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod cp_fm_pool_types.mod qs_rho_types.mod xc_rho_cflags_types.mod admm_types.mod xc_derivative_set_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod ewald_environment_types.mod pw_types.mod xc_rho_set_types.mod qs_tddfpt2_stda_types.mod input_section_types.mod ewald_pw_types.mod kinds.mod cp_fm_vect.mod cp_gemm_interface.mod qs_rho_methods.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_tddfpt2_subgroups.mod xc.mod cp_blacs_env.mod xc_derivatives.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_types.F qs_tddfpt2_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:08:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_types.mod' due to: qs_tddfpt2_types.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod cp_fm_pool_types.mod qs_rho_types.mod xc_rho_cflags_types.mod admm_types.mod xc_derivative_set_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod ewald_environment_types.mod pw_types.mod xc_rho_set_types.mod qs_tddfpt2_stda_types.mod input_section_types.mod ewald_pw_types.mod kinds.mod cp_fm_vect.mod cp_gemm_interface.mod qs_rho_methods.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_tddfpt2_subgroups.mod xc.mod cp_blacs_env.mod xc_derivatives.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_pot_saop.o' due to: /build/reproducible-path/cp2k-8.1/src/xc_pot_saop.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod qs_rho_types.mod qs_mo_types.mod xc_rho_cflags_types.mod qs_oce_types.mod xc_derivative_set_types.mod cp_fm_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_vxc_atom.mod kinds.mod qs_integrate_potential.mod qs_ks_atom.mod cp_dbcsr_operations.mod qs_harmonics_atom.mod qs_collocate_density.mod qs_grid_atom.mod util.mod cp_array_utils.mod qs_rho_atom_methods.mod pw_methods.mod xc.mod xc_derivatives.mod qs_gapw_densities.mod base_hooks.mod mathconstants.mod xc_atom.mod input_constants.mod xc_xbecke88.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc_pot_saop.F xc_pot_saop.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:08:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc_pot_saop.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_pot_saop.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_pot_saop.mod' due to: xc_pot_saop.o /build/reproducible-path/cp2k-8.1/src/xc_pot_saop.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod qs_rho_types.mod qs_mo_types.mod xc_rho_cflags_types.mod qs_oce_types.mod xc_derivative_set_types.mod cp_fm_types.mod qs_local_rho_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod xc_derivative_types.mod xc_rho_set_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_vxc_atom.mod kinds.mod qs_integrate_potential.mod qs_ks_atom.mod cp_dbcsr_operations.mod qs_harmonics_atom.mod qs_collocate_density.mod qs_grid_atom.mod util.mod cp_array_utils.mod qs_rho_atom_methods.mod pw_methods.mod xc.mod xc_derivatives.mod qs_gapw_densities.mod base_hooks.mod mathconstants.mod xc_atom.mod input_constants.mod xc_xbecke88.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod cell_types.mod qs_mo_types.mod qs_scf_types.mod qs_tddfpt2_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod xtb_matrices.mod cp_gemm_interface.mod physcon.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_fm_cholesky.mod qs_ks_methods.mod cp_fm_basic_linalg.mod util.mod cp_array_utils.mod cp_blacs_env.mod base_hooks.mod xc_pot_saop.mod input_constants.mod qs_scf_post_gpw.mod qs_scf_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_utils.F qs_tddfpt2_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:09:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_utils.mod' due to: qs_tddfpt2_utils.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod cell_types.mod qs_mo_types.mod qs_scf_types.mod qs_tddfpt2_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod xtb_matrices.mod cp_gemm_interface.mod physcon.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_fm_cholesky.mod qs_ks_methods.mod cp_fm_basic_linalg.mod util.mod cp_array_utils.mod cp_blacs_env.mod base_hooks.mod xc_pot_saop.mod input_constants.mod qs_scf_post_gpw.mod qs_scf_methods.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_densities.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_densities.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_ks_types.mod pw_types.mod qs_rho_types.mod cp_fm_types.mod qs_tddfpt2_subgroups.mod kinds.mod base_hooks.mod cp_gemm_interface.mod cp_dbcsr_operations.mod qs_collocate_density.mod qs_rho_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_densities.F qs_tddfpt2_densities.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:09:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_densities.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_densities.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_densities.mod' due to: qs_tddfpt2_densities.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_densities.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_ks_types.mod pw_types.mod qs_rho_types.mod cp_fm_types.mod qs_tddfpt2_subgroups.mod kinds.mod base_hooks.mod cp_gemm_interface.mod cp_dbcsr_operations.mod qs_collocate_density.mod qs_rho_methods.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_operators.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_operators.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qs_rho_types.mod admm_types.mod pw_poisson_types.mod qs_tddfpt2_types.mod cp_fm_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod xc_rho_set_types.mod kinds.mod hfx_admm_utils.mod cp_gemm_interface.mod cp_fm_struct.mod cp_dbcsr_operations.mod pw_poisson_methods.mod cp_fm_basic_linalg.mod pw_methods.mod xc.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_operators.F qs_tddfpt2_operators.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:09:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_operators.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_operators.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_operators.mod' due to: qs_tddfpt2_operators.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_operators.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod qs_rho_types.mod admm_types.mod pw_poisson_types.mod qs_tddfpt2_types.mod cp_fm_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod xc_rho_set_types.mod kinds.mod hfx_admm_utils.mod cp_gemm_interface.mod cp_fm_struct.mod cp_dbcsr_operations.mod pw_poisson_methods.mod cp_fm_basic_linalg.mod pw_methods.mod xc.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_restart.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_restart.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_tddfpt2_types.mod cp_fm_pool_types.mod cp_fm_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod cp_output_handling.mod cp_blacs_env.mod string_utilities.mod cp_fm_basic_linalg.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_restart.F qs_tddfpt2_restart.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:09:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_restart.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_restart.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_restart.mod' due to: qs_tddfpt2_restart.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_restart.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_tddfpt2_types.mod cp_fm_pool_types.mod cp_fm_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod cp_output_handling.mod cp_blacs_env.mod string_utilities.mod cp_fm_basic_linalg.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_stda_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod scf_control_types.mod particle_types.mod cell_types.mod atprop_types.mod qs_tddfpt2_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod qs_tddfpt2_stda_types.mod input_section_types.mod virial_types.mod ewald_pw_types.mod cp_control_types.mod cp_log_handling.mod ewald_methods_tb.mod kinds.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_tddfpt2_subgroups.mod cp_fm_basic_linalg.mod util.mod iterate_matrix.mod particle_methods.mod base_hooks.mod mathconstants.mod cp_fm_diag.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_utils.F qs_tddfpt2_stda_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:09:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_stda_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_stda_utils.F90 +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_utils.F:183:39: + + 183 | cstring = "GAMMA EXCHANGE MATRIX" + | 1 +Warning: CHARACTER expression will be truncated in assignment (20/21) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_utils.F:343:47: + + 343 | CALL copy_dbcsr_to_fm(sm_s, fm_s_half) + | ^ +Warning: 'sm_s' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_stda_utils.mod' due to: qs_tddfpt2_stda_utils.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod scf_control_types.mod particle_types.mod cell_types.mod atprop_types.mod qs_tddfpt2_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod ewald_environment_types.mod qs_kind_types.mod qs_tddfpt2_stda_types.mod input_section_types.mod virial_types.mod ewald_pw_types.mod cp_control_types.mod cp_log_handling.mod ewald_methods_tb.mod kinds.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_tddfpt2_subgroups.mod cp_fm_basic_linalg.mod util.mod iterate_matrix.mod particle_methods.mod base_hooks.mod mathconstants.mod cp_fm_diag.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_fhxc.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_fhxc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_tddfpt2_types.mod cp_fm_types.mod qs_environment_types.mod pw_types.mod qs_tddfpt2_stda_types.mod cp_control_types.mod qs_tddfpt2_operators.mod kinds.mod qs_integrate_potential.mod cp_gemm_interface.mod qs_rho_methods.mod cp_dbcsr_operations.mod qs_tddfpt2_densities.mod qs_tddfpt2_subgroups.mod pw_methods.mod qs_tddfpt2_stda_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_fhxc.F qs_tddfpt2_fhxc.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:09:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_fhxc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_fhxc.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_fhxc.mod' due to: qs_tddfpt2_fhxc.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_fhxc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_tddfpt2_types.mod cp_fm_types.mod qs_environment_types.mod pw_types.mod qs_tddfpt2_stda_types.mod cp_control_types.mod qs_tddfpt2_operators.mod kinds.mod qs_integrate_potential.mod cp_gemm_interface.mod qs_rho_methods.mod cp_dbcsr_operations.mod qs_tddfpt2_densities.mod qs_tddfpt2_subgroups.mod pw_methods.mod qs_tddfpt2_stda_utils.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_eigensolver.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_eigensolver.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod qs_tddfpt2_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod qs_tddfpt2_operators.mod qs_tddfpt2_utils.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_tddfpt2_subgroups.mod cp_fm_basic_linalg.mod memory_utilities.mod qs_tddfpt2_restart.mod cp_blacs_env.mod machine.mod base_hooks.mod cp_fm_diag.mod input_constants.mod qs_scf_methods.mod qs_tddfpt2_fhxc.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_eigensolver.F qs_tddfpt2_eigensolver.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:09:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_eigensolver.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_eigensolver.F90 +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_eigensolver.F:390:25: + + 390 | IF (do_hfx .AND. .NOT. is_stda) THEN + | ^ +Warning: 'is_stda' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_eigensolver.F:321:93: + + 321 | LOGICAL :: do_admm, is_rks_triplets, is_stda + | ^ +note: 'is_stda' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_eigensolver.mod' due to: qs_tddfpt2_eigensolver.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_eigensolver.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod qs_tddfpt2_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod qs_tddfpt2_operators.mod qs_tddfpt2_utils.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_tddfpt2_subgroups.mod cp_fm_basic_linalg.mod memory_utilities.mod qs_tddfpt2_restart.mod cp_blacs_env.mod machine.mod base_hooks.mod cp_fm_diag.mod input_constants.mod qs_scf_methods.mod qs_tddfpt2_fhxc.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_properties.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_properties.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_mo_types.mod pw_poisson_types.mod particle_list_types.mod qs_tddfpt2_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_cfm_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_output_handling.mod cp_fm_struct.mod qs_moments.mod bibliography.mod dbcsr_vector.mod cp_dbcsr_operations.mod message_passing.mod cp_cfm_basic_linalg.mod kahan_sum.mod cp_realspace_grid_cube.mod qs_collocate_density.mod string_utilities.mod moments_utils.mod cp_fm_basic_linalg.mod util.mod qs_operators_ao.mod cp_blacs_env.mod molden_utils.mod base_hooks.mod mathconstants.mod cp_fm_diag.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_properties.F qs_tddfpt2_properties.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:09:29 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_properties.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_properties.F90 +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_properties.F:680:76: + + 680 | nmo_virt_occ_alpha = INT(nmo_virt(1), int_8)*INT(nmo_occ(1), int_8) + | ^ +Warning: 'nmo_virt[0]' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_properties.F:680:76: Warning: 'nmo_occ[0]' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_properties.F:654:72: + + 654 | weights_recv + | ^ +Warning: 'weights_recv.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_properties.mod' due to: qs_tddfpt2_properties.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_properties.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_mo_types.mod pw_poisson_types.mod particle_list_types.mod qs_tddfpt2_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_cfm_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod physcon.mod cp_output_handling.mod cp_fm_struct.mod qs_moments.mod bibliography.mod dbcsr_vector.mod cp_dbcsr_operations.mod message_passing.mod cp_cfm_basic_linalg.mod kahan_sum.mod cp_realspace_grid_cube.mod qs_collocate_density.mod string_utilities.mod moments_utils.mod cp_fm_basic_linalg.mod util.mod qs_operators_ao.mod cp_blacs_env.mod molden_utils.mod base_hooks.mod mathconstants.mod cp_fm_diag.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cell_types.mod qs_mo_types.mod admm_types.mod qs_scf_types.mod qs_tddfpt2_types.mod cp_fm_types.mod qs_environment_types.mod qs_tddfpt2_stda_types.mod input_section_types.mod cp_control_types.mod qs_tddfpt2_utils.mod cp_log_handling.mod kinds.mod cp_output_handling.mod bibliography.mod cp_dbcsr_operations.mod qs_tddfpt2_densities.mod qs_tddfpt2_subgroups.mod string_utilities.mod qs_tddfpt2_eigensolver.mod qs_tddfpt2_restart.mod cp_blacs_env.mod qs_tddfpt2_properties.mod machine.mod qs_tddfpt2_stda_utils.mod base_hooks.mod header.mod input_constants.mod qs_scf_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_methods.F qs_tddfpt2_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:09:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_methods.F90 +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_methods.F:262:31: + + 262 | ALLOCATE (evals(nstates)) + | ^ +Warning: 'nstates' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_methods.F:393:13: + + 393 | IF (do_admm) CALL tddfpt_release_kernel_env(kernel_env%admm_kernel) + | ^ +Warning: 'do_admm' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_methods.mod' due to: qs_tddfpt2_methods.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cell_types.mod qs_mo_types.mod admm_types.mod qs_scf_types.mod qs_tddfpt2_types.mod cp_fm_types.mod qs_environment_types.mod qs_tddfpt2_stda_types.mod input_section_types.mod cp_control_types.mod qs_tddfpt2_utils.mod cp_log_handling.mod kinds.mod cp_output_handling.mod bibliography.mod cp_dbcsr_operations.mod qs_tddfpt2_densities.mod qs_tddfpt2_subgroups.mod string_utilities.mod qs_tddfpt2_eigensolver.mod qs_tddfpt2_restart.mod cp_blacs_env.mod qs_tddfpt2_properties.mod machine.mod qs_tddfpt2_stda_utils.mod base_hooks.mod header.mod input_constants.mod qs_scf_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'et_coupling.o' due to: /build/reproducible-path/cp2k-8.1/src/et_coupling.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_types.mod input_section_types.mod qs_energy_types.mod cp_gemm_interface.mod cp_fm_struct.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod mathlib.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'et_coupling.o' due to: /build/reproducible-path/cp2k-8.1/src/et_coupling.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod qs_mo_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod mathlib.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/et_coupling.F et_coupling.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:01:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"et_coupling.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' et_coupling.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:09:37 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"et_coupling.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' et_coupling.F90 /build/reproducible-path/cp2k-8.1/src/et_coupling.F:222:23: 222 | W_mat(1, 1) = Wbb @@ -45870,21 +45777,21 @@ 243 | a(1) = (energy%total + strength*Wbb)*Sda - strength*Wda | ^ Warning: 'strength' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'et_coupling.mod' due to: et_coupling.o /build/reproducible-path/cp2k-8.1/src/et_coupling.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_types.mod input_section_types.mod qs_energy_types.mod cp_gemm_interface.mod cp_fm_struct.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod mathlib.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'et_coupling.mod' due to: et_coupling.o /build/reproducible-path/cp2k-8.1/src/et_coupling.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod qs_mo_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_matrix_pools.mod cp_fm_basic_linalg.mod mathlib.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_ri_libint.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_ri_libint.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod mp2_types.mod input_constants.mod cp_fm_diag.mod cp_fm_struct.mod t_sh_p_s_c.mod cp_blacs_env.mod cp_files.mod kinds.mod hfx_screening_methods.mod hfx_energy_potential.mod hfx_pair_list_methods.mod cp_fm_basic_linalg.mod message_passing.mod libint_wrapper.mod cp_fm_cholesky.mod gamma.mod base_hooks.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_ri_libint.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_ri_libint.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod hfx_types.mod particle_types.mod cell_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod cp_control_types.mod t_sh_p_s_c.mod kinds.mod cp_fm_struct.mod gamma.mod message_passing.mod libint_wrapper.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod cp_files.mod orbital_pointers.mod hfx_pair_list_methods.mod cp_blacs_env.mod base_hooks.mod hfx_screening_methods.mod cp_fm_diag.mod input_constants.mod hfx_energy_potential.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_ri_libint.F mp2_ri_libint.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:01:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_libint.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_libint.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:09:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_libint.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_libint.F90 /build/reproducible-path/cp2k-8.1/src/mp2_ri_libint.F:1311:3: 1311 | FUNCTION calc_cond_num(matrix, size_matrix) RESULT(cond_num) | ^ Warning: 'calc_cond_num' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_ri_libint.mod' due to: mp2_ri_libint.o /build/reproducible-path/cp2k-8.1/src/mp2_ri_libint.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod mp2_types.mod input_constants.mod cp_fm_diag.mod cp_fm_struct.mod t_sh_p_s_c.mod cp_blacs_env.mod cp_files.mod kinds.mod hfx_screening_methods.mod hfx_energy_potential.mod hfx_pair_list_methods.mod cp_fm_basic_linalg.mod message_passing.mod libint_wrapper.mod cp_fm_cholesky.mod gamma.mod base_hooks.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_ri_libint.mod' due to: mp2_ri_libint.o /build/reproducible-path/cp2k-8.1/src/mp2_ri_libint.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod hfx_types.mod particle_types.mod cell_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod cp_control_types.mod t_sh_p_s_c.mod kinds.mod cp_fm_struct.mod gamma.mod message_passing.mod libint_wrapper.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod cp_files.mod orbital_pointers.mod hfx_pair_list_methods.mod cp_blacs_env.mod base_hooks.mod hfx_screening_methods.mod cp_fm_diag.mod input_constants.mod hfx_energy_potential.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_direct_method.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_direct_method.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod hfx_types.mod mp2_types.mod input_constants.mod mathconstants.mod t_sh_p_s_c.mod kinds.mod hfx_energy_potential.mod hfx_pair_list_methods.mod message_passing.mod libint_wrapper.mod mp2_ri_libint.mod cp_log_handling.mod base_hooks.mod hfx_load_balance_methods.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_direct_method.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_direct_method.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod hfx_types.mod particle_types.mod cell_types.mod qs_environment_types.mod t_sh_p_s_c.mod cp_log_handling.mod kinds.mod message_passing.mod libint_wrapper.mod mp2_ri_libint.mod orbital_pointers.mod hfx_pair_list_methods.mod base_hooks.mod hfx_load_balance_methods.mod mathconstants.mod input_constants.mod hfx_energy_potential.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_direct_method.F mp2_direct_method.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:01:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_direct_method.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_direct_method.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:09:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_direct_method.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_direct_method.F90 /build/reproducible-path/cp2k-8.1/src/mp2_direct_method.F:978:64: 978 | R_start, Rsize_rec, s, S_global, S_offset, S_offset_rec, Ssize_rec @@ -45920,11 +45827,11 @@ 562 | task_counter_RS(global_counter, 4) = task_counter_RS(global_counter, 4) + 1 | ^ Warning: 'global_counter' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_direct_method.mod' due to: mp2_direct_method.o /build/reproducible-path/cp2k-8.1/src/mp2_direct_method.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod hfx_types.mod mp2_types.mod input_constants.mod mathconstants.mod t_sh_p_s_c.mod kinds.mod hfx_energy_potential.mod hfx_pair_list_methods.mod message_passing.mod libint_wrapper.mod mp2_ri_libint.mod cp_log_handling.mod base_hooks.mod hfx_load_balance_methods.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_direct_method.mod' due to: mp2_direct_method.o /build/reproducible-path/cp2k-8.1/src/mp2_direct_method.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod hfx_types.mod particle_types.mod cell_types.mod qs_environment_types.mod t_sh_p_s_c.mod cp_log_handling.mod kinds.mod message_passing.mod libint_wrapper.mod mp2_ri_libint.mod orbital_pointers.mod hfx_pair_list_methods.mod base_hooks.mod hfx_load_balance_methods.mod mathconstants.mod input_constants.mod hfx_energy_potential.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_optimize_ri_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_optimize_ri_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod basis_set_container_types.mod hfx_types.mod atomic_kind_types.mod mp2_types.mod mp2_direct_method.mod util.mod kinds.mod message_passing.mod libint_wrapper.mod mp2_ri_libint.mod cp_para_env.mod orbital_symbols.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod machine.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_optimize_ri_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_optimize_ri_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod hfx_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod basis_set_container_types.mod cp_log_handling.mod kinds.mod message_passing.mod libint_wrapper.mod mp2_ri_libint.mod cp_para_env.mod memory_utilities.mod util.mod orbital_pointers.mod machine.mod base_hooks.mod mp2_direct_method.mod orbital_symbols.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_optimize_ri_basis.F mp2_optimize_ri_basis.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:02:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_optimize_ri_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_optimize_ri_basis.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:09:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_optimize_ri_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_optimize_ri_basis.F90 /build/reproducible-path/cp2k-8.1/src/mp2_optimize_ri_basis.F:942:87: 942 | max_min_exp_per_l(1, la) = MAX(max_min_exp_per_l(1, la), exp_limits(1, ikind)) @@ -45935,21 +45842,120 @@ 892 | iset, la | ^ note: 'la' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_optimize_ri_basis.mod' due to: mp2_optimize_ri_basis.o /build/reproducible-path/cp2k-8.1/src/mp2_optimize_ri_basis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod basis_set_container_types.mod hfx_types.mod atomic_kind_types.mod mp2_types.mod mp2_direct_method.mod util.mod kinds.mod message_passing.mod libint_wrapper.mod mp2_ri_libint.mod cp_para_env.mod orbital_symbols.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod machine.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_optimize_ri_basis.mod' due to: mp2_optimize_ri_basis.o /build/reproducible-path/cp2k-8.1/src/mp2_optimize_ri_basis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod hfx_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod basis_set_container_types.mod cp_log_handling.mod kinds.mod message_passing.mod libint_wrapper.mod mp2_ri_libint.mod cp_para_env.mod memory_utilities.mod util.mod orbital_pointers.mod machine.mod base_hooks.mod mp2_direct_method.mod orbital_symbols.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'group_dist_types.o' due to: /build/reproducible-path/cp2k-8.1/src/group_dist_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod message_passing.mod util.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'group_dist_types.o' due to: /build/reproducible-path/cp2k-8.1/src/group_dist_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod util.mod message_passing.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/group_dist_types.F group_dist_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:02:32 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"group_dist_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' group_dist_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'group_dist_types.mod' due to: group_dist_types.o /build/reproducible-path/cp2k-8.1/src/group_dist_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod message_passing.mod util.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:10:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"group_dist_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' group_dist_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'group_dist_types.mod' due to: group_dist_types.o /build/reproducible-path/cp2k-8.1/src/group_dist_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod base_hooks.mod util.mod message_passing.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_rse.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_rse.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod qs_ks_types.mod qs_rho_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod cp_gemm_interface.mod cp_dbcsr_cp2k_link.mod qs_ks_utils.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_vxc.mod cp_fm_basic_linalg.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod hfx_energy_potential.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_rse.F rpa_rse.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:10:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_rse.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_rse.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_rse.mod' due to: rpa_rse.o /build/reproducible-path/cp2k-8.1/src/rpa_rse.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod qs_ks_types.mod qs_rho_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod cp_gemm_interface.mod cp_dbcsr_cp2k_link.mod qs_ks_utils.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod qs_vxc.mod cp_fm_basic_linalg.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod hfx_energy_potential.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_ri_grad_util.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_ri_grad_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_fm_types.mod message_passing.mod util.mod kinds.mod base_hooks.mod cp_gemm_interface.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_ri_grad_util.F mp2_ri_grad_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:10:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_grad_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_grad_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_ri_grad_util.mod' due to: mp2_ri_grad_util.o /build/reproducible-path/cp2k-8.1/src/mp2_ri_grad_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_fm_types.mod message_passing.mod util.mod kinds.mod base_hooks.mod cp_gemm_interface.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_ri_gpw.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod message_passing.mod kinds.mod cp_para_env.mod mp2_ri_grad_util.mod machine.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F mp2_ri_gpw.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:10:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_gpw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_gpw.F90 +/build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F:2582:68: + + 2582 | para_env_exchange%group) + | ^ +Warning: 'send_k' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F:2551:65: + + 2551 | para_env_exchange%group) + | ^ +Warning: 'send_j' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F:2524:65: + + 2524 | para_env_exchange%group) + | ^ +Warning: 'send_i' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F:720:45: + + 720 | gd_array%sizes(:) = sizes_array_orig + | ^ +Warning: 'MEM[(struct array01_integer(kind=4) &)&sizes_array_orig].dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_ri_gpw.mod' due to: mp2_ri_gpw.o /build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod message_passing.mod kinds.mod cp_para_env.mod mp2_ri_grad_util.mod machine.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_eri_gpw.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_eri_gpw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod task_list_methods.mod pw_methods.mod pw_env_methods.mod kinds.mod rs_pw_interface.mod pw_poisson_methods.mod qs_integrate_potential.mod ao_util.mod gaussian_gridlevels.mod message_passing.mod qs_collocate_density.mod base_hooks.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_eri_gpw.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_eri_gpw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod task_list_types.mod realspace_grid_types.mod kinds.mod qs_integrate_potential.mod pw_env_methods.mod message_passing.mod pw_poisson_methods.mod task_list_methods.mod qs_collocate_density.mod orbital_pointers.mod pw_methods.mod rs_pw_interface.mod base_hooks.mod gaussian_gridlevels.mod ao_util.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_eri_gpw.F mp2_eri_gpw.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:02:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_eri_gpw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_eri_gpw.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_eri_gpw.mod' due to: mp2_eri_gpw.o /build/reproducible-path/cp2k-8.1/src/mp2_eri_gpw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod task_list_methods.mod pw_methods.mod pw_env_methods.mod kinds.mod rs_pw_interface.mod pw_poisson_methods.mod qs_integrate_potential.mod ao_util.mod gaussian_gridlevels.mod message_passing.mod qs_collocate_density.mod base_hooks.mod orbital_pointers.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:10:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_eri_gpw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_eri_gpw.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_eri_gpw.mod' due to: mp2_eri_gpw.o /build/reproducible-path/cp2k-8.1/src/mp2_eri_gpw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod task_list_types.mod realspace_grid_types.mod kinds.mod qs_integrate_potential.mod pw_env_methods.mod message_passing.mod pw_poisson_methods.mod task_list_methods.mod qs_collocate_density.mod orbital_pointers.mod pw_methods.mod rs_pw_interface.mod base_hooks.mod gaussian_gridlevels.mod ao_util.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_gpw_method.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod group_dist_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod task_list_types.mod kinds.mod qs_integrate_potential.mod cp_fm_struct.mod message_passing.mod cp_dbcsr_operations.mod mp2_eri_gpw.mod qs_collocate_density.mod cp_para_env.mod cp_blacs_env.mod machine.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F mp2_gpw_method.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:10:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_gpw_method.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_gpw_method.F90 +/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:162:65: + + 162 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: BIb_C, BIb_Ex, BIb_send + | ^ +Warning: 'bib_c.dim[2].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:162:65: Warning: 'bib_c.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:162:65: Warning: 'bib_c.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:566:65: + + 566 | - Eigenval(j + EX_start - 1)) + | ^ +Warning: 'bib_c.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:438:36: + + 438 | IF (calc_ex) BIb_C = 0.0_dp + | ^ +Warning: 'bib_c.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:535:127: + + 535 | /(Eigenval(a) + Eigenval(homo + b_global) - Eigenval(i + my_I_occupied_start - 1) - Eigenval(j)) + | ^ +Warning: 'bib_c.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:381:68: + + 381 | sub_sub_color = color_array(para_env_sub%mepos, my_q_position) + | ^ +Warning: 'my_q_position' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:335:94: + + 335 | my_I_occupied_end = my_I_occupied_start + vector_batch_I_size_group(i_group_counter) - 1 + | ^ +Warning: 'i_group_counter' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_gpw_method.mod' due to: mp2_gpw_method.o /build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_pool_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod group_dist_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod task_list_types.mod kinds.mod qs_integrate_potential.mod cp_fm_struct.mod message_passing.mod cp_dbcsr_operations.mod mp2_eri_gpw.mod qs_collocate_density.mod cp_para_env.mod cp_blacs_env.mod machine.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'linear_systems.mod' due to: linear_systems.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_cphf.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_cphf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod hfx_types.mod pw_pool_types.mod qs_ks_types.mod qs_force_types.mod qs_rho_types.mod pw_poisson_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod cp_gemm_interface.mod qs_integrate_potential.mod cp_dbcsr_cp2k_link.mod qs_rho_methods.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod kahan_sum.mod mp2_eri_gpw.mod pw_poisson_methods.mod qs_collocate_density.mod cp_fm_basic_linalg.mod pw_methods.mod cp_blacs_env.mod machine.mod base_hooks.mod mathconstants.mod hfx_energy_potential.mod linear_systems.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_cphf.F mp2_cphf.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:10:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_cphf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_cphf.F90 +/build/reproducible-path/cp2k-8.1/src/mp2_cphf.F:1814:27: + + 1814 | DEALLOCATE (Ax_ba) + | ^ +Warning: 'ax_ba.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_cphf.F:1812:27: + + 1812 | DEALLOCATE (Ax_bb) + | ^ +Warning: 'ax_bb.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_cphf.F:1813:27: + + 1813 | DEALLOCATE (Ax_ab) + | ^ +Warning: 'ax_ab.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_cphf.F:1811:26: + + 1811 | DEALLOCATE (xn_b) + | ^ +Warning: 'xn_b.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_cphf.mod' due to: mp2_cphf.o /build/reproducible-path/cp2k-8.1/src/mp2_cphf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod hfx_types.mod pw_pool_types.mod qs_ks_types.mod qs_force_types.mod qs_rho_types.mod pw_poisson_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod input_section_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod cp_gemm_interface.mod qs_integrate_potential.mod cp_dbcsr_cp2k_link.mod qs_rho_methods.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod kahan_sum.mod mp2_eri_gpw.mod pw_poisson_methods.mod qs_collocate_density.mod cp_fm_basic_linalg.mod pw_methods.mod cp_blacs_env.mod machine.mod base_hooks.mod mathconstants.mod hfx_energy_potential.mod linear_systems.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_eri.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_eri.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod eri_mme_types.mod input_constants.mod util.mod kinds.mod ai_coulomb.mod qs_integral_utils.mod message_passing.mod eri_mme_integrate.mod eri_mme_test.mod ai_contraction_sphi.mod base_hooks.mod orbital_pointers.mod cp_eri_mme_interface.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_eri.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_eri.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod eri_mme_types.mod eri_mme_test.mod ai_coulomb.mod kinds.mod ai_contraction_sphi.mod message_passing.mod qs_integral_utils.mod util.mod cp_eri_mme_interface.mod orbital_pointers.mod base_hooks.mod eri_mme_integrate.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_eri.F mp2_eri.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:02:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_eri.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_eri.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:10:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_eri.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_eri.F90 /build/reproducible-path/cp2k-8.1/src/mp2_eri.F:1381:71: 1381 | ncoa, ncob, ncoc, nsgfa, nsgfb, nsgfc) @@ -46230,11 +46236,11 @@ 744 | IF (jatom /= last_jatom) THEN | ^ Warning: 'last_jatom' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_eri.mod' due to: mp2_eri.o /build/reproducible-path/cp2k-8.1/src/mp2_eri.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod atomic_kind_types.mod input_section_types.mod eri_mme_types.mod input_constants.mod util.mod kinds.mod ai_coulomb.mod qs_integral_utils.mod message_passing.mod eri_mme_integrate.mod eri_mme_test.mod ai_contraction_sphi.mod base_hooks.mod orbital_pointers.mod cp_eri_mme_interface.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_eri.mod' due to: mp2_eri.o /build/reproducible-path/cp2k-8.1/src/mp2_eri.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod eri_mme_types.mod eri_mme_test.mod ai_coulomb.mod kinds.mod ai_contraction_sphi.mod message_passing.mod qs_integral_utils.mod util.mod cp_eri_mme_interface.mod orbital_pointers.mod base_hooks.mod eri_mme_integrate.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kpoint_coulomb_2c.o' due to: /build/reproducible-path/cp2k-8.1/src/kpoint_coulomb_2c.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod particle_types.mod cell_types.mod kpoint_types.mod mathconstants.mod base_hooks.mod generic_shg_integrals_init.mod generic_shg_integrals.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'kpoint_coulomb_2c.o' due to: /build/reproducible-path/cp2k-8.1/src/kpoint_coulomb_2c.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod kpoint_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod particle_types.mod mathconstants.mod kinds.mod generic_shg_integrals_init.mod base_hooks.mod generic_shg_integrals.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/kpoint_coulomb_2c.F kpoint_coulomb_2c.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:03:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_coulomb_2c.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_coulomb_2c.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:11:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"kpoint_coulomb_2c.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' kpoint_coulomb_2c.F90 /build/reproducible-path/cp2k-8.1/src/kpoint_coulomb_2c.F:207:44: 207 | k_z > z_max .OR. k_z < z_min) CYCLE @@ -46270,31 +46276,52 @@ 197 | DO i_x_outer = x_min, x_max + nkp_grid(1), 2*nkp_grid(1) | ^ Warning: 'x_max' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kpoint_coulomb_2c.mod' due to: kpoint_coulomb_2c.o /build/reproducible-path/cp2k-8.1/src/kpoint_coulomb_2c.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod particle_types.mod cell_types.mod kpoint_types.mod mathconstants.mod base_hooks.mod generic_shg_integrals_init.mod generic_shg_integrals.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_ri_grad_util.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_ri_grad_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod cp_para_types.mod group_dist_types.mod cp_fm_types.mod message_passing.mod cp_gemm_interface.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod util.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_ri_grad_util.F mp2_ri_grad_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:03:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_grad_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_grad_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_ri_grad_util.mod' due to: mp2_ri_grad_util.o /build/reproducible-path/cp2k-8.1/src/mp2_ri_grad_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod cp_para_types.mod group_dist_types.mod cp_fm_types.mod message_passing.mod cp_gemm_interface.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'kpoint_coulomb_2c.mod' due to: kpoint_coulomb_2c.o /build/reproducible-path/cp2k-8.1/src/kpoint_coulomb_2c.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod kpoint_types.mod qs_kind_types.mod atomic_kind_types.mod cell_types.mod particle_types.mod mathconstants.mod kinds.mod generic_shg_integrals_init.mod base_hooks.mod generic_shg_integrals.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_communication.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_communication.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod cp_para_types.mod group_dist_types.mod cp_fm_types.mod message_passing.mod mp2_ri_grad_util.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_communication.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_communication.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_fm_types.mod message_passing.mod util.mod kinds.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod mp2_ri_grad_util.mod cp_dbcsr_operations.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_communication.F rpa_communication.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:03:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_communication.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_communication.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_communication.mod' due to: rpa_communication.o /build/reproducible-path/cp2k-8.1/src/rpa_communication.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod cp_para_types.mod group_dist_types.mod cp_fm_types.mod message_passing.mod mp2_ri_grad_util.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod util.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:11:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_communication.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_communication.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_communication.mod' due to: rpa_communication.o /build/reproducible-path/cp2k-8.1/src/rpa_communication.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_fm_types.mod message_passing.mod util.mod kinds.mod base_hooks.mod cp_blacs_env.mod cp_fm_struct.mod mp2_ri_grad_util.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_ri_2c.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_ri_2c.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod group_dist_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod cp_cfm_types.mod atomic_kind_types.mod mp2_types.mod qs_ks_types.mod input_constants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod libint_2c_3c.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod qs_tensors.mod kpoint_methods.mod qs_interactions.mod kpoint_coulomb_2c.mod mp2_eri_gpw.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_integral_utils.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_fm_cholesky.mod cp_para_env.mod particle_methods.mod rpa_communication.mod base_hooks.mod constants_operator.mod mp2_eri.mod cp_eri_mme_interface.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_ri_2c.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_ri_2c.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod cell_types.mod group_dist_types.mod cp_fm_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_cfm_types.mod cp_control_types.mod kinds.mod cp_gemm_interface.mod cp_dbcsr_cp2k_link.mod qs_interactions.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_cfm_basic_linalg.mod mp2_eri_gpw.mod qs_integral_utils.mod cp_fm_cholesky.mod cp_para_env.mod cp_fm_basic_linalg.mod constants_operator.mod cp_eri_mme_interface.mod libint_2c_3c.mod particle_methods.mod cp_blacs_env.mod mp2_eri.mod kpoint_coulomb_2c.mod base_hooks.mod qs_tensors.mod cp_fm_diag.mod rpa_communication.mod input_constants.mod kpoint_methods.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_ri_2c.F mp2_ri_2c.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:03:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_2c.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_2c.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_ri_2c.mod' due to: mp2_ri_2c.o /build/reproducible-path/cp2k-8.1/src/mp2_ri_2c.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod group_dist_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod cp_cfm_types.mod atomic_kind_types.mod mp2_types.mod qs_ks_types.mod input_constants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod libint_2c_3c.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod qs_tensors.mod kpoint_methods.mod qs_interactions.mod kpoint_coulomb_2c.mod mp2_eri_gpw.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_integral_utils.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_fm_cholesky.mod cp_para_env.mod particle_methods.mod rpa_communication.mod base_hooks.mod constants_operator.mod mp2_eri.mod cp_eri_mme_interface.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:11:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_2c.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_2c.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_ri_2c.mod' due to: mp2_ri_2c.o /build/reproducible-path/cp2k-8.1/src/mp2_ri_2c.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod cell_types.mod group_dist_types.mod cp_fm_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_cfm_types.mod cp_control_types.mod kinds.mod cp_gemm_interface.mod cp_dbcsr_cp2k_link.mod qs_interactions.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_cfm_basic_linalg.mod mp2_eri_gpw.mod qs_integral_utils.mod cp_fm_cholesky.mod cp_para_env.mod cp_fm_basic_linalg.mod constants_operator.mod cp_eri_mme_interface.mod libint_2c_3c.mod particle_methods.mod cp_blacs_env.mod mp2_eri.mod kpoint_coulomb_2c.mod base_hooks.mod qs_tensors.mod cp_fm_diag.mod rpa_communication.mod input_constants.mod kpoint_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_tensors_types.mod group_dist_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod task_list_types.mod input_constants.mod libint_2c_3c.mod cp_fm_struct.mod cp_blacs_env.mod util.mod kinds.mod qs_tensors.mod kpoint_methods.mod mp2_eri_gpw.mod cp_dbcsr_operations.mod qs_integral_utils.mod message_passing.mod bibliography.mod cp_para_env.mod particle_methods.mod base_hooks.mod mp2_eri.mod machine.mod mp2_ri_2c.mod cp_units.mod cp_eri_mme_interface.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod kpoint_types.mod pw_pool_types.mod particle_types.mod cell_types.mod group_dist_types.mod pw_poisson_types.mod cp_fm_types.mod qs_tensors_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod qs_neighbor_list_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod task_list_types.mod kinds.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod mp2_eri_gpw.mod qs_integral_utils.mod cp_para_env.mod util.mod cp_eri_mme_interface.mod libint_2c_3c.mod particle_methods.mod cp_blacs_env.mod mp2_eri.mod machine.mod mp2_ri_2c.mod base_hooks.mod qs_tensors.mod input_constants.mod kpoint_methods.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_integrals.F mp2_integrals.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:03:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_integrals.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_integrals.mod' due to: mp2_integrals.o /build/reproducible-path/cp2k-8.1/src/mp2_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_tensors_types.mod group_dist_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod task_list_types.mod input_constants.mod libint_2c_3c.mod cp_fm_struct.mod cp_blacs_env.mod util.mod kinds.mod qs_tensors.mod kpoint_methods.mod mp2_eri_gpw.mod cp_dbcsr_operations.mod qs_integral_utils.mod message_passing.mod bibliography.mod cp_para_env.mod particle_methods.mod base_hooks.mod mp2_eri.mod machine.mod mp2_ri_2c.mod cp_units.mod cp_eri_mme_interface.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:11:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_integrals.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_integrals.mod' due to: mp2_integrals.o /build/reproducible-path/cp2k-8.1/src/mp2_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod kpoint_types.mod pw_pool_types.mod particle_types.mod cell_types.mod group_dist_types.mod pw_poisson_types.mod cp_fm_types.mod qs_tensors_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod qs_neighbor_list_types.mod pw_types.mod qs_kind_types.mod cp_control_types.mod task_list_types.mod kinds.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod mp2_eri_gpw.mod qs_integral_utils.mod cp_para_env.mod util.mod cp_eri_mme_interface.mod libint_2c_3c.mod particle_methods.mod cp_blacs_env.mod mp2_eri.mod machine.mod mp2_ri_2c.mod base_hooks.mod qs_tensors.mod input_constants.mod kpoint_methods.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_ri_grad.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_force_types.mod pw_poisson_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod qs_neighbor_list_types.mod pw_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod task_list_types.mod realspace_grid_types.mod kinds.mod cp_gemm_interface.mod qs_integrate_potential.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod mp2_eri_gpw.mod pw_poisson_methods.mod qs_collocate_density.mod cp_para_env.mod util.mod cp_eri_mme_interface.mod orbital_pointers.mod pw_methods.mod cp_blacs_env.mod mp2_eri.mod rs_pw_interface.mod base_hooks.mod gaussian_gridlevels.mod mathconstants.mod ao_util.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F mp2_ri_grad.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:12:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_grad.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_grad.F90 +/build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F:190:79: + + 190 | TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: G_P_ia, G_P_ia_beta, mat_munu_local, & + | ^ +Warning: 'g_p_ia_beta.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F:190:79: Warning: 'g_p_ia_beta.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F:919:33: + + 919 | DEALLOCATE (G_P_ia_beta) + | ^ +Warning: 'g_p_ia_beta.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F:317:119: + + 317 | G_P_ia_beta(L_counter), matrix_P_inu_beta, mo_coeff_v_beta, mo_coeff_o_beta) + | ^ +Warning: 'mo_coeff_v_beta' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_ri_grad.mod' due to: mp2_ri_grad.o /build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod pw_pool_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_force_types.mod pw_poisson_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod pw_env_types.mod qs_neighbor_list_types.mod pw_types.mod qs_kind_types.mod virial_types.mod cp_control_types.mod task_list_types.mod realspace_grid_types.mod kinds.mod cp_gemm_interface.mod qs_integrate_potential.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod mp2_eri_gpw.mod pw_poisson_methods.mod qs_collocate_density.mod cp_para_env.mod util.mod cp_eri_mme_interface.mod orbital_pointers.mod pw_methods.mod cp_blacs_env.mod mp2_eri.mod rs_pw_interface.mod base_hooks.mod gaussian_gridlevels.mod mathconstants.mod ao_util.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_laplace.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_laplace.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_laplace.F mp2_laplace.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:12:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_laplace.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_laplace.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_laplace.mod' due to: mp2_laplace.o /build/reproducible-path/cp2k-8.1/src/mp2_laplace.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_im_time.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_im_time.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_mo_types.mod cell_types.mod kpoint_types.mod cp_para_types.mod qs_tensors_types.mod qs_environment_types.mod cp_control_types.mod hfx_types.mod cp_fm_types.mod mp2_types.mod mathconstants.mod cp_gemm_interface.mod cp_fm_struct.mod kinds.mod qs_tensors.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod base_hooks.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_im_time.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_im_time.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod mp2_types.mod kpoint_types.mod cell_types.mod qs_mo_types.mod cp_fm_types.mod qs_tensors_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_control_types.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_fm_basic_linalg.mod machine.mod base_hooks.mod mathconstants.mod qs_tensors.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_im_time.F rpa_im_time.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:04:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_im_time.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_im_time.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:12:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_im_time.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_im_time.F90 /build/reproducible-path/cp2k-8.1/src/rpa_im_time.F:370:52: 370 | occ_O = occ_O + occ @@ -46325,11 +46352,11 @@ 406 | nze_M_occ = nze_M_occ + nze | ^ Warning: 'nze_m_occ' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_im_time.mod' due to: rpa_im_time.o /build/reproducible-path/cp2k-8.1/src/rpa_im_time.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_mo_types.mod cell_types.mod kpoint_types.mod cp_para_types.mod qs_tensors_types.mod qs_environment_types.mod cp_control_types.mod hfx_types.mod cp_fm_types.mod mp2_types.mod mathconstants.mod cp_gemm_interface.mod cp_fm_struct.mod kinds.mod qs_tensors.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod base_hooks.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_im_time.mod' due to: rpa_im_time.o /build/reproducible-path/cp2k-8.1/src/rpa_im_time.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod mp2_types.mod kpoint_types.mod cell_types.mod qs_mo_types.mod cp_fm_types.mod qs_tensors_types.mod qs_environment_types.mod qs_neighbor_list_types.mod cp_control_types.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_fm_basic_linalg.mod machine.mod base_hooks.mod mathconstants.mod qs_tensors.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_gw_kpoints.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_gw_kpoints.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod cp_fm_types.mod cp_cfm_types.mod mathconstants.mod cp_cfm_basic_linalg.mod kinds.mod rpa_im_time.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_integral_utils.mod message_passing.mod particle_methods.mod mathlib.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_gw_kpoints.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_gw_kpoints.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod particle_types.mod cell_types.mod cp_fm_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod cp_cfm_types.mod kinds.mod cp_dbcsr_operations.mod message_passing.mod cp_cfm_basic_linalg.mod qs_integral_utils.mod cp_fm_basic_linalg.mod mathlib.mod particle_methods.mod base_hooks.mod mathconstants.mod rpa_im_time.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_gw_kpoints.F rpa_gw_kpoints.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:04:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_gw_kpoints.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_gw_kpoints.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:12:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_gw_kpoints.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_gw_kpoints.F90 /build/reproducible-path/cp2k-8.1/src/rpa_gw_kpoints.F:793:33: 793 | SUBROUTINE trace_for_self_ener(mat_contr_W_re, mat_contr_W_im, n_level_gw, jquad, & @@ -46361,31 +46388,16 @@ | ^ Warning: 'weight_re' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/rpa_gw_kpoints.F:301:81: Warning: 'weight_im' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_gw_kpoints.mod' due to: rpa_gw_kpoints.o /build/reproducible-path/cp2k-8.1/src/rpa_gw_kpoints.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod cp_fm_types.mod cp_cfm_types.mod mathconstants.mod cp_cfm_basic_linalg.mod kinds.mod rpa_im_time.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_integral_utils.mod message_passing.mod particle_methods.mod mathlib.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_laplace.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_laplace.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_laplace.F mp2_laplace.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:04:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_laplace.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_laplace.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_laplace.mod' due to: mp2_laplace.o /build/reproducible-path/cp2k-8.1/src/mp2_laplace.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_gw_kpoints.mod' due to: rpa_gw_kpoints.o /build/reproducible-path/cp2k-8.1/src/rpa_gw_kpoints.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod kpoint_types.mod particle_types.mod cell_types.mod cp_fm_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod cp_cfm_types.mod kinds.mod cp_dbcsr_operations.mod message_passing.mod cp_cfm_basic_linalg.mod qs_integral_utils.mod cp_fm_basic_linalg.mod mathlib.mod particle_methods.mod base_hooks.mod mathconstants.mod rpa_im_time.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_util.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod kpoint_types.mod cp_para_types.mod qs_environment_types.mod hfx_types.mod cp_fm_types.mod cp_cfm_types.mod mp2_types.mod input_constants.mod mathconstants.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod rpa_gw_kpoints.mod mp2_laplace.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod cp_fm_cholesky.mod cp_para_env.mod rpa_communication.mod base_hooks.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_util.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod mp2_types.mod kpoint_types.mod cell_types.mod cp_fm_types.mod qs_environment_types.mod cp_cfm_types.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_fm_cholesky.mod cp_para_env.mod cp_fm_basic_linalg.mod cp_blacs_env.mod machine.mod mp2_laplace.mod rpa_gw_kpoints.mod base_hooks.mod mathconstants.mod rpa_communication.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_util.F rpa_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:04:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_util.mod' due to: rpa_util.o /build/reproducible-path/cp2k-8.1/src/rpa_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod kpoint_types.mod cp_para_types.mod qs_environment_types.mod hfx_types.mod cp_fm_types.mod cp_cfm_types.mod mp2_types.mod input_constants.mod mathconstants.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod rpa_gw_kpoints.mod mp2_laplace.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod cp_fm_cholesky.mod cp_para_env.mod rpa_communication.mod base_hooks.mod machine.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_axk.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_axk.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod mp2_types.mod input_section_types.mod qs_energy_types.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod util.mod kinds.mod hfx_energy_potential.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod rpa_communication.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_axk.F rpa_axk.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:04:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_axk.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_axk.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_axk.mod' due to: rpa_axk.o /build/reproducible-path/cp2k-8.1/src/rpa_axk.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod mp2_types.mod input_section_types.mod qs_energy_types.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod util.mod kinds.mod hfx_energy_potential.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod rpa_communication.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:12:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_util.mod' due to: rpa_util.o /build/reproducible-path/cp2k-8.1/src/rpa_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod mp2_types.mod kpoint_types.mod cell_types.mod cp_fm_types.mod qs_environment_types.mod cp_cfm_types.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_fm_cholesky.mod cp_para_env.mod cp_fm_basic_linalg.mod cp_blacs_env.mod machine.mod mp2_laplace.mod rpa_gw_kpoints.mod base_hooks.mod mathconstants.mod rpa_communication.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'bse.o' due to: /build/reproducible-path/cp2k-8.1/src/bse.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod cp_para_types.mod group_dist_types.mod cp_fm_types.mod rpa_communication.mod message_passing.mod cp_gemm_interface.mod base_hooks.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/bse.F bse.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:04:32 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"bse.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bse.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'bse.mod' due to: bse.o /build/reproducible-path/cp2k-8.1/src/bse.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod cp_para_types.mod group_dist_types.mod cp_fm_types.mod rpa_communication.mod message_passing.mod cp_gemm_interface.mod base_hooks.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'minimax_rpa.o' due to: /build/reproducible-path/cp2k-8.1/src/minimax/minimax_rpa.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'minimax_rpa.o' due to: /build/reproducible-path/cp2k-8.1/src/minimax/minimax_rpa.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/minimax/minimax_rpa.F minimax_rpa.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:04:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_rpa.F\"" -I'/build/reproducible-path/cp2k-8.1/src/minimax/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_rpa.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:12:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_rpa.F\"" -I'/build/reproducible-path/cp2k-8.1/src/minimax/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_rpa.F90 /build/reproducible-path/cp2k-8.1/src/minimax/minimax_rpa.F:10164:33: 10164 | E_ratio = E_ratio/1.5_dp @@ -46396,11 +46408,11 @@ 10129 | REAL(KIND=dp) :: E_ratio | ^ note: 'e_ratio' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'minimax_rpa.mod' due to: minimax_rpa.o /build/reproducible-path/cp2k-8.1/src/minimax/minimax_rpa.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'minimax_rpa.mod' due to: minimax_rpa.o /build/reproducible-path/cp2k-8.1/src/minimax/minimax_rpa.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'minimax_exp_gw.o' due to: /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_gw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'minimax_exp_gw.o' due to: /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_gw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_gw.F minimax_exp_gw.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:04:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_exp_gw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/minimax/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_exp_gw.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:12:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"minimax/minimax_exp_gw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/minimax/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' minimax_exp_gw.F90 /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_gw.F:80:33: 80 | E_ratio = E_ratio/1.5_dp @@ -46411,11 +46423,11 @@ 45 | REAL(KIND=dp) :: E_ratio | ^ note: 'e_ratio' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'minimax_exp_gw.mod' due to: minimax_exp_gw.o /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_gw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'minimax_exp_gw.mod' due to: minimax_exp_gw.o /build/reproducible-path/cp2k-8.1/src/minimax/minimax_exp_gw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_grids.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_grids.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod cp_para_types.mod qs_environment_types.mod qs_mo_types.mod kpoint_types.mod cp_fm_types.mod machine.mod minimax_exp.mod mathconstants.mod message_passing.mod base_hooks.mod minimax_rpa.mod cp_para_env.mod minimax_exp_gw.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_grids.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_grids.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod qs_environment_types.mod kpoint_types.mod cp_fm_types.mod qs_mo_types.mod message_passing.mod minimax_exp.mod mathconstants.mod kinds.mod minimax_rpa.mod cp_para_env.mod minimax_exp_gw.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_grids.F mp2_grids.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:04:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_grids.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_grids.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:12:29 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_grids.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_grids.F90 /build/reproducible-path/cp2k-8.1/src/mp2_grids.F:489:10: 489 | IF (ABS(left_term + right_term) >= conv_param) THEN @@ -46426,16 +46438,16 @@ 490 | IF (a_scaling >= 2*num_integ_points*step) THEN | ^ Warning: 'a_scaling' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_grids.mod' due to: mp2_grids.o /build/reproducible-path/cp2k-8.1/src/mp2_grids.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod cp_para_types.mod qs_environment_types.mod qs_mo_types.mod kpoint_types.mod cp_fm_types.mod machine.mod minimax_exp.mod mathconstants.mod message_passing.mod base_hooks.mod minimax_rpa.mod cp_para_env.mod minimax_exp_gw.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_grids.mod' due to: mp2_grids.o /build/reproducible-path/cp2k-8.1/src/mp2_grids.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod qs_environment_types.mod kpoint_types.mod cp_fm_types.mod qs_mo_types.mod message_passing.mod minimax_exp.mod mathconstants.mod kinds.mod minimax_rpa.mod cp_para_env.mod minimax_exp_gw.mod machine.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_gw_im_time_util.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_gw_im_time_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_tensors_types.mod qs_environment_types.mod particle_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod mp2_types.mod kinds.mod qs_tensors.mod cp_dbcsr_operations.mod qs_integral_utils.mod message_passing.mod particle_methods.mod rpa_communication.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_gw_im_time_util.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_gw_im_time_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod mp2_types.mod particle_types.mod cell_types.mod qs_tensors_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod kinds.mod cp_dbcsr_operations.mod message_passing.mod qs_integral_utils.mod particle_methods.mod base_hooks.mod qs_tensors.mod rpa_communication.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_gw_im_time_util.F rpa_gw_im_time_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:04:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_gw_im_time_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_gw_im_time_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_gw_im_time_util.mod' due to: rpa_gw_im_time_util.o /build/reproducible-path/cp2k-8.1/src/rpa_gw_im_time_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_tensors_types.mod qs_environment_types.mod particle_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod mp2_types.mod kinds.mod qs_tensors.mod cp_dbcsr_operations.mod qs_integral_utils.mod message_passing.mod particle_methods.mod rpa_communication.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:12:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_gw_im_time_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_gw_im_time_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_gw_im_time_util.mod' due to: rpa_gw_im_time_util.o /build/reproducible-path/cp2k-8.1/src/rpa_gw_im_time_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod mp2_types.mod particle_types.mod cell_types.mod qs_tensors_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_kind_types.mod kinds.mod cp_dbcsr_operations.mod message_passing.mod qs_integral_utils.mod particle_methods.mod base_hooks.mod qs_tensors.mod rpa_communication.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_gw.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_gw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_tensors_types.mod qs_environment_types.mod particle_types.mod hfx_types.mod cp_fm_types.mod cp_cfm_types.mod mp2_types.mod qs_ks_types.mod input_constants.mod mathconstants.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_files.mod kinds.mod qs_tensors.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod qs_integral_utils.mod message_passing.mod rpa_gw_im_time_util.mod cp_fm_cholesky.mod qs_overlap.mod qs_gamma2kp.mod base_hooks.mod qs_neighbor_lists.mod qs_moments.mod qs_band_structure.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_gw.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_gw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod mp2_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_mo_types.mod cp_fm_types.mod qs_tensors_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_cfm_types.mod kinds.mod qs_gamma2kp.mod cp_gemm_interface.mod physcon.mod cp_fm_struct.mod qs_moments.mod cp_dbcsr_operations.mod message_passing.mod qs_neighbor_lists.mod qs_integral_utils.mod cp_fm_cholesky.mod qs_band_structure.mod cp_fm_basic_linalg.mod cp_files.mod base_hooks.mod mathconstants.mod qs_tensors.mod cp_fm_diag.mod qs_overlap.mod input_constants.mod rpa_gw_im_time_util.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_gw.F rpa_gw.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:04:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_gw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_gw.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:12:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_gw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_gw.F90 /build/reproducible-path/cp2k-8.1/src/rpa_gw.F:2959:63: 2959 | /REAL(degeneracy, KIND=dp) @@ -46451,11 +46463,16 @@ 3510 | REAL(KIND=dp) :: e_fermi, energy_val, level_energ_GW, & | ^ note: 'level_energ_gw' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_gw.mod' due to: rpa_gw.o /build/reproducible-path/cp2k-8.1/src/rpa_gw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_tensors_types.mod qs_environment_types.mod particle_types.mod hfx_types.mod cp_fm_types.mod cp_cfm_types.mod mp2_types.mod qs_ks_types.mod input_constants.mod mathconstants.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_files.mod kinds.mod qs_tensors.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod qs_integral_utils.mod message_passing.mod rpa_gw_im_time_util.mod cp_fm_cholesky.mod qs_overlap.mod qs_gamma2kp.mod base_hooks.mod qs_neighbor_lists.mod qs_moments.mod qs_band_structure.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_gw.mod' due to: rpa_gw.o /build/reproducible-path/cp2k-8.1/src/rpa_gw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod mp2_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_mo_types.mod cp_fm_types.mod qs_tensors_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod cp_cfm_types.mod kinds.mod qs_gamma2kp.mod cp_gemm_interface.mod physcon.mod cp_fm_struct.mod qs_moments.mod cp_dbcsr_operations.mod message_passing.mod qs_neighbor_lists.mod qs_integral_utils.mod cp_fm_cholesky.mod qs_band_structure.mod cp_fm_basic_linalg.mod cp_files.mod base_hooks.mod mathconstants.mod qs_tensors.mod cp_fm_diag.mod qs_overlap.mod input_constants.mod rpa_gw_im_time_util.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_axk.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_axk.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod hfx_types.mod particle_types.mod cell_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod util.mod base_hooks.mod cp_fm_diag.mod rpa_communication.mod hfx_energy_potential.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_axk.F rpa_axk.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:12:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_axk.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_axk.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_axk.mod' due to: rpa_axk.o /build/reproducible-path/cp2k-8.1/src/rpa_axk.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod hfx_types.mod particle_types.mod cell_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_kind_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod qs_energy_types.mod kinds.mod cp_gemm_interface.mod cp_fm_struct.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod util.mod base_hooks.mod cp_fm_diag.mod rpa_communication.mod hfx_energy_potential.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_gw_ic.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_gw_ic.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod cp_para_types.mod qs_tensors_types.mod cp_fm_types.mod rpa_communication.mod message_passing.mod base_hooks.mod cp_dbcsr_operations.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_gw_ic.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_gw_ic.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod qs_tensors_types.mod cp_fm_types.mod message_passing.mod kinds.mod rpa_communication.mod base_hooks.mod cp_dbcsr_operations.mod physcon.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_gw_ic.F rpa_gw_ic.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:05:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_gw_ic.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_gw_ic.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:12:56 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_gw_ic.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_gw_ic.F90 /build/reproducible-path/cp2k-8.1/src/rpa_gw_ic.F:298:32: 298 | SUBROUTINE print_Neaton_value(fm_mat_M_occ, unit_nr, gw_corr_lev_occ, para_env, do_homo, do_lumo) @@ -46486,141 +46503,31 @@ 992 | SUBROUTINE fill_coeff_dbcsr_virt(coeff_dbcsr, coeff, homo) | ^ Warning: 'fill_coeff_dbcsr_virt' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_gw_ic.mod' due to: rpa_gw_ic.o /build/reproducible-path/cp2k-8.1/src/rpa_gw_ic.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod cp_para_types.mod qs_tensors_types.mod cp_fm_types.mod rpa_communication.mod message_passing.mod base_hooks.mod cp_dbcsr_operations.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_gw_ic.mod' due to: rpa_gw_ic.o /build/reproducible-path/cp2k-8.1/src/rpa_gw_ic.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod qs_tensors_types.mod cp_fm_types.mod message_passing.mod kinds.mod rpa_communication.mod base_hooks.mod cp_dbcsr_operations.mod physcon.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_kpoints.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_kpoints.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_para_types.mod particle_types.mod qs_environment_types.mod cell_types.mod kpoint_types.mod cp_fm_types.mod rpa_gw_kpoints.mod base_hooks.mod mathconstants.mod message_passing.mod cp_cfm_basic_linalg.mod rpa_im_time.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_kpoints.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_kpoints.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_cfm_types.mod kpoint_types.mod particle_types.mod cell_types.mod cp_fm_types.mod rpa_gw_kpoints.mod message_passing.mod cp_cfm_basic_linalg.mod mathconstants.mod kinds.mod rpa_im_time.mod base_hooks.mod cp_dbcsr_operations.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_kpoints.F rpa_kpoints.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:05:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_kpoints.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_kpoints.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_kpoints.mod' due to: rpa_kpoints.o /build/reproducible-path/cp2k-8.1/src/rpa_kpoints.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_para_types.mod particle_types.mod qs_environment_types.mod cell_types.mod kpoint_types.mod cp_fm_types.mod rpa_gw_kpoints.mod base_hooks.mod mathconstants.mod message_passing.mod cp_cfm_basic_linalg.mod rpa_im_time.mod cp_dbcsr_operations.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_main.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_main.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod cp_para_types.mod group_dist_types.mod qs_environment_types.mod hfx_types.mod cp_fm_types.mod cp_cfm_types.mod mp2_types.mod rpa_util.mod input_constants.mod mathconstants.mod rpa_axk.mod cp_fm_struct.mod bse.mod cp_blacs_env.mod mp2_grids.mod rpa_gw.mod kinds.mod util.mod mp2_laplace.mod rpa_im_time.mod cp_fm_basic_linalg.mod message_passing.mod bibliography.mod cp_para_env.mod mp2_ri_grad_util.mod minimax_exp.mod rpa_communication.mod base_hooks.mod rpa_gw_ic.mod rpa_kpoints.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_main.F rpa_main.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:05:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_main.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_main.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_main.mod' due to: rpa_main.o /build/reproducible-path/cp2k-8.1/src/rpa_main.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod cp_para_types.mod group_dist_types.mod qs_environment_types.mod hfx_types.mod cp_fm_types.mod cp_cfm_types.mod mp2_types.mod rpa_util.mod input_constants.mod mathconstants.mod rpa_axk.mod cp_fm_struct.mod bse.mod cp_blacs_env.mod mp2_grids.mod rpa_gw.mod kinds.mod util.mod mp2_laplace.mod rpa_im_time.mod cp_fm_basic_linalg.mod message_passing.mod bibliography.mod cp_para_env.mod mp2_ri_grad_util.mod minimax_exp.mod rpa_communication.mod base_hooks.mod rpa_gw_ic.mod rpa_kpoints.mod machine.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_ri_grad.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod mp2_types.mod qs_force_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod pw_methods.mod mathconstants.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod util.mod kinds.mod rs_pw_interface.mod pw_poisson_methods.mod qs_integrate_potential.mod mp2_eri_gpw.mod cp_dbcsr_operations.mod ao_util.mod gaussian_gridlevels.mod message_passing.mod qs_collocate_density.mod cp_para_env.mod base_hooks.mod mp2_eri.mod orbital_pointers.mod cp_eri_mme_interface.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F mp2_ri_grad.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:05:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_grad.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_grad.F90 -/build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F:190:79: - - 190 | TYPE(dbcsr_p_type), DIMENSION(:), POINTER :: G_P_ia, G_P_ia_beta, mat_munu_local, & - | ^ -Warning: 'g_p_ia_beta.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F:190:79: Warning: 'g_p_ia_beta.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F:919:33: - - 919 | DEALLOCATE (G_P_ia_beta) - | ^ -Warning: 'g_p_ia_beta.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F:317:119: - - 317 | G_P_ia_beta(L_counter), matrix_P_inu_beta, mo_coeff_v_beta, mo_coeff_o_beta) - | ^ -Warning: 'mo_coeff_v_beta' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_ri_grad.mod' due to: mp2_ri_grad.o /build/reproducible-path/cp2k-8.1/src/mp2_ri_grad.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod mp2_types.mod qs_force_types.mod qs_ks_types.mod task_list_types.mod input_constants.mod pw_methods.mod mathconstants.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod util.mod kinds.mod rs_pw_interface.mod pw_poisson_methods.mod qs_integrate_potential.mod mp2_eri_gpw.mod cp_dbcsr_operations.mod ao_util.mod gaussian_gridlevels.mod message_passing.mod qs_collocate_density.mod cp_para_env.mod base_hooks.mod mp2_eri.mod orbital_pointers.mod cp_eri_mme_interface.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'linear_systems.mod' due to: linear_systems.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_cphf.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_cphf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod pw_poisson_types.mod pw_pool_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod mp2_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod qs_energy_types.mod pw_methods.mod mathconstants.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod qs_rho_methods.mod kinds.mod kahan_sum.mod pw_poisson_methods.mod hfx_energy_potential.mod qs_integrate_potential.mod mp2_eri_gpw.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod linear_systems.mod message_passing.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod base_hooks.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_cphf.F mp2_cphf.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:05:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_cphf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_cphf.F90 -/build/reproducible-path/cp2k-8.1/src/mp2_cphf.F:1814:27: - - 1814 | DEALLOCATE (Ax_ba) - | ^ -Warning: 'ax_ba.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_cphf.F:1812:27: - - 1812 | DEALLOCATE (Ax_bb) - | ^ -Warning: 'ax_bb.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_cphf.F:1813:27: - - 1813 | DEALLOCATE (Ax_ab) - | ^ -Warning: 'ax_ab.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_cphf.F:1811:26: - - 1811 | DEALLOCATE (xn_b) - | ^ -Warning: 'xn_b.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_cphf.mod' due to: mp2_cphf.o /build/reproducible-path/cp2k-8.1/src/mp2_cphf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod pw_poisson_types.mod pw_pool_types.mod hfx_types.mod cp_fm_types.mod atomic_kind_types.mod mp2_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod qs_energy_types.mod pw_methods.mod mathconstants.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod qs_rho_methods.mod kinds.mod kahan_sum.mod pw_poisson_methods.mod hfx_energy_potential.mod qs_integrate_potential.mod mp2_eri_gpw.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod linear_systems.mod message_passing.mod qs_collocate_density.mod cp_dbcsr_cp2k_link.mod base_hooks.mod machine.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_gpw_method.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod group_dist_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod task_list_types.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod qs_integrate_potential.mod mp2_eri_gpw.mod cp_dbcsr_operations.mod message_passing.mod qs_collocate_density.mod cp_para_env.mod base_hooks.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F mp2_gpw_method.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:06:00 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_gpw_method.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_gpw_method.F90 -/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:162:65: - - 162 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :, :) :: BIb_C, BIb_Ex, BIb_send - | ^ -Warning: 'bib_c.dim[2].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:162:65: Warning: 'bib_c.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:162:65: Warning: 'bib_c.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:566:65: - - 566 | - Eigenval(j + EX_start - 1)) - | ^ -Warning: 'bib_c.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:438:36: - - 438 | IF (calc_ex) BIb_C = 0.0_dp - | ^ -Warning: 'bib_c.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:535:127: - - 535 | /(Eigenval(a) + Eigenval(homo + b_global) - Eigenval(i + my_I_occupied_start - 1) - Eigenval(j)) - | ^ -Warning: 'bib_c.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:381:68: - - 381 | sub_sub_color = color_array(para_env_sub%mepos, my_q_position) - | ^ -Warning: 'my_q_position' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F:335:94: - - 335 | my_I_occupied_end = my_I_occupied_start + vector_batch_I_size_group(i_group_counter) - 1 - | ^ -Warning: 'i_group_counter' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_gpw_method.mod' due to: mp2_gpw_method.o /build/reproducible-path/cp2k-8.1/src/mp2_gpw_method.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod group_dist_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod task_list_types.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod qs_integrate_potential.mod mp2_eri_gpw.mod cp_dbcsr_operations.mod message_passing.mod qs_collocate_density.mod cp_para_env.mod base_hooks.mod machine.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:12:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_kpoints.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_kpoints.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_kpoints.mod' due to: rpa_kpoints.o /build/reproducible-path/cp2k-8.1/src/rpa_kpoints.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_cfm_types.mod kpoint_types.mod particle_types.mod cell_types.mod cp_fm_types.mod rpa_gw_kpoints.mod message_passing.mod cp_cfm_basic_linalg.mod mathconstants.mod kinds.mod rpa_im_time.mod base_hooks.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_ri_gpw.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod cp_para_types.mod group_dist_types.mod machine.mod message_passing.mod mp2_ri_grad_util.mod base_hooks.mod cp_para_env.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F mp2_ri_gpw.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:06:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_ri_gpw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_ri_gpw.F90 -/build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F:2582:68: - - 2582 | para_env_exchange%group) - | ^ -Warning: 'send_k' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F:2551:65: - - 2551 | para_env_exchange%group) - | ^ -Warning: 'send_j' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F:2524:65: - - 2524 | para_env_exchange%group) - | ^ -Warning: 'send_i' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F:720:45: - - 720 | gd_array%sizes(:) = sizes_array_orig - | ^ -Warning: 'MEM[(struct array01_integer(kind=4) &)&sizes_array_orig].dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_ri_gpw.mod' due to: mp2_ri_gpw.o /build/reproducible-path/cp2k-8.1/src/mp2_ri_gpw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mp2_types.mod cp_para_types.mod group_dist_types.mod machine.mod message_passing.mod mp2_ri_grad_util.mod base_hooks.mod cp_para_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'bse.o' due to: /build/reproducible-path/cp2k-8.1/src/bse.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_fm_types.mod message_passing.mod kinds.mod rpa_communication.mod cp_gemm_interface.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/bse.F bse.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"bse.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bse.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'bse.mod' due to: bse.o /build/reproducible-path/cp2k-8.1/src/bse.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod group_dist_types.mod mp2_types.mod cp_fm_types.mod message_passing.mod kinds.mod rpa_communication.mod cp_gemm_interface.mod cp_fm_cholesky.mod cp_fm_basic_linalg.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_rse.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_rse.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_types.mod mp2_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod qs_vxc.mod cp_blacs_env.mod kinds.mod hfx_energy_potential.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod cp_dbcsr_cp2k_link.mod base_hooks.mod qs_ks_utils.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_rse.F rpa_rse.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:06:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_rse.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_rse.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_rse.mod' due to: rpa_rse.o /build/reproducible-path/cp2k-8.1/src/rpa_rse.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_types.mod mp2_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod qs_vxc.mod cp_blacs_env.mod kinds.mod hfx_energy_potential.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod cp_dbcsr_cp2k_link.mod base_hooks.mod qs_ks_utils.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rpa_main.o' due to: /build/reproducible-path/cp2k-8.1/src/rpa_main.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod mp2_types.mod kpoint_types.mod group_dist_types.mod cp_fm_types.mod qs_environment_types.mod cp_cfm_types.mod minimax_exp.mod kinds.mod rpa_util.mod mp2_grids.mod cp_fm_struct.mod bibliography.mod message_passing.mod cp_para_env.mod mp2_ri_grad_util.mod cp_fm_basic_linalg.mod util.mod cp_blacs_env.mod rpa_gw.mod rpa_axk.mod machine.mod mp2_laplace.mod base_hooks.mod mathconstants.mod rpa_im_time.mod rpa_communication.mod rpa_gw_ic.mod input_constants.mod rpa_kpoints.mod bse.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rpa_main.F rpa_main.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rpa_main.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rpa_main.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rpa_main.mod' due to: rpa_main.o /build/reproducible-path/cp2k-8.1/src/rpa_main.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod mp2_types.mod kpoint_types.mod group_dist_types.mod cp_fm_types.mod qs_environment_types.mod cp_cfm_types.mod minimax_exp.mod kinds.mod rpa_util.mod mp2_grids.mod cp_fm_struct.mod bibliography.mod message_passing.mod cp_para_env.mod mp2_ri_grad_util.mod cp_fm_basic_linalg.mod util.mod cp_blacs_env.mod rpa_gw.mod rpa_axk.mod machine.mod mp2_laplace.mod base_hooks.mod mathconstants.mod rpa_im_time.mod rpa_communication.mod rpa_gw_ic.mod input_constants.mod rpa_kpoints.mod bse.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_gpw.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_gpw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod qs_mo_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod group_dist_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod molecule_kind_types.mod hfx_types.mod distribution_1d_types.mod cp_fm_types.mod atomic_kind_types.mod mp2_types.mod input_section_types.mod qs_ks_types.mod molecule_types.mod input_constants.mod cp_fm_struct.mod cp_blacs_env.mod distribution_methods.mod mp2_integrals.mod kinds.mod rpa_main.mod mp2_ri_grad.mod qs_interactions.mod mp2_cphf.mod cp_dbcsr_operations.mod mp2_gpw_method.mod mp2_ri_gpw.mod qs_integral_utils.mod message_passing.mod libint_wrapper.mod cp_dbcsr_cp2k_link.mod rpa_rse.mod cp_para_env.mod particle_methods.mod cp_log_handling.mod base_hooks.mod qs_neighbor_lists.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2_gpw.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2_gpw.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod mp2_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_mo_types.mod group_dist_types.mod molecule_types.mod cp_fm_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_dbcsr_cp2k_link.mod qs_interactions.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod libint_wrapper.mod rpa_rse.mod mp2_ri_gpw.mod qs_neighbor_lists.mod qs_integral_utils.mod cp_para_env.mod mp2_gpw_method.mod mp2_cphf.mod particle_methods.mod cp_blacs_env.mod mp2_integrals.mod distribution_methods.mod machine.mod base_hooks.mod input_constants.mod mp2_ri_grad.mod rpa_main.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2_gpw.F mp2_gpw.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:06:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_gpw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_gpw.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_gpw.mod' due to: mp2_gpw.o /build/reproducible-path/cp2k-8.1/src/mp2_gpw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod kpoint_types.mod qs_kind_types.mod qs_mo_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod group_dist_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod molecule_kind_types.mod hfx_types.mod distribution_1d_types.mod cp_fm_types.mod atomic_kind_types.mod mp2_types.mod input_section_types.mod qs_ks_types.mod molecule_types.mod input_constants.mod cp_fm_struct.mod cp_blacs_env.mod distribution_methods.mod mp2_integrals.mod kinds.mod rpa_main.mod mp2_ri_grad.mod qs_interactions.mod mp2_cphf.mod cp_dbcsr_operations.mod mp2_gpw_method.mod mp2_ri_gpw.mod qs_integral_utils.mod message_passing.mod libint_wrapper.mod cp_dbcsr_cp2k_link.mod rpa_rse.mod cp_para_env.mod particle_methods.mod cp_log_handling.mod base_hooks.mod qs_neighbor_lists.mod machine.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2_gpw.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2_gpw.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2_gpw.mod' due to: mp2_gpw.o /build/reproducible-path/cp2k-8.1/src/mp2_gpw.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod hfx_types.mod mp2_types.mod kpoint_types.mod qs_ks_types.mod particle_types.mod cell_types.mod qs_mo_types.mod group_dist_types.mod molecule_types.mod cp_fm_types.mod atomic_kind_types.mod distribution_2d_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_dbcsr_cp2k_link.mod qs_interactions.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod libint_wrapper.mod rpa_rse.mod mp2_ri_gpw.mod qs_neighbor_lists.mod qs_integral_utils.mod cp_para_env.mod mp2_gpw_method.mod mp2_cphf.mod particle_methods.mod cp_blacs_env.mod mp2_integrals.mod distribution_methods.mod machine.mod base_hooks.mod input_constants.mod mp2_ri_grad.mod rpa_main.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_rho_types.mod qs_neighbor_list_types.mod kpoint_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod qs_scf_types.mod cp_fm_types.mod cp_cfm_types.mod atomic_kind_types.mod mp2_types.mod scf_control_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod admm_methods.mod input_constants.mod mathconstants.mod qs_ks_methods.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod mp2_direct_method.mod mp2_optimize_ri_basis.mod cp_fm_struct.mod cp_files.mod cp_blacs_env.mod qs_matrix_pools.mod kinds.mod hfx_energy_potential.mod kpoint_methods.mod mp2_gpw.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod physcon.mod message_passing.mod cp_dbcsr_cp2k_link.mod bibliography.mod admm_utils.mod cp_fm_cholesky.mod cp_para_env.mod qs_scf_methods.mod cp_log_handling.mod base_hooks.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mp2.o' due to: /build/reproducible-path/cp2k-8.1/src/mp2.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod hfx_types.mod kpoint_types.mod qs_ks_types.mod scf_control_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_cfm_types.mod cp_control_types.mod qs_energy_types.mod admm_utils.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod cp_cfm_basic_linalg.mod qs_matrix_pools.mod cp_fm_cholesky.mod cp_para_env.mod qs_ks_methods.mod cp_fm_basic_linalg.mod cp_files.mod cp_blacs_env.mod machine.mod base_hooks.mod mathconstants.mod mp2_direct_method.mod mp2_optimize_ri_basis.mod cp_fm_diag.mod input_constants.mod mp2_gpw.mod kpoint_methods.mod qs_scf_methods.mod hfx_energy_potential.mod admm_methods.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mp2.F mp2.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:06:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mp2.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mp2.F90 /build/reproducible-path/cp2k-8.1/src/mp2.F:1080:45: 1080 | j_batch_start = my_J_occupied_start - 1 @@ -46681,495 +46588,553 @@ 772 | IF (n_threads == 1 .OR. actual_x_data%memory_parameter%do_disk_storage) do_dynamic_load_balancing = .FALSE. | ^ Warning: 'n_threads' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2.mod' due to: mp2.o /build/reproducible-path/cp2k-8.1/src/mp2.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_rho_types.mod qs_neighbor_list_types.mod kpoint_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod hfx_types.mod qs_scf_types.mod cp_fm_types.mod cp_cfm_types.mod atomic_kind_types.mod mp2_types.mod scf_control_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod admm_methods.mod input_constants.mod mathconstants.mod qs_ks_methods.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod mp2_direct_method.mod mp2_optimize_ri_basis.mod cp_fm_struct.mod cp_files.mod cp_blacs_env.mod qs_matrix_pools.mod kinds.mod hfx_energy_potential.mod kpoint_methods.mod mp2_gpw.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod physcon.mod message_passing.mod cp_dbcsr_cp2k_link.mod bibliography.mod admm_utils.mod cp_fm_cholesky.mod cp_para_env.mod qs_scf_methods.mod cp_log_handling.mod base_hooks.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mp2.mod' due to: mp2.o /build/reproducible-path/cp2k-8.1/src/mp2.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mp2_types.mod hfx_types.mod kpoint_types.mod qs_ks_types.mod scf_control_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_cfm_types.mod cp_control_types.mod qs_energy_types.mod admm_utils.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod cp_cfm_basic_linalg.mod qs_matrix_pools.mod cp_fm_cholesky.mod cp_para_env.mod qs_ks_methods.mod cp_fm_basic_linalg.mod cp_files.mod cp_blacs_env.mod machine.mod base_hooks.mod mathconstants.mod mp2_direct_method.mod mp2_optimize_ri_basis.mod cp_fm_diag.mod input_constants.mod mp2_gpw.mod kpoint_methods.mod qs_scf_methods.mod hfx_energy_potential.mod admm_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_nmr_epr_common_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_epr_common_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_pool_types.mod cell_types.mod pw_grid_types.mod pw_methods.mod base_hooks.mod mathconstants.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_epr_common_utils.F qs_linres_nmr_epr_common_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:07:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_nmr_epr_common_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_nmr_epr_common_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_nmr_epr_common_utils.mod' due to: qs_linres_nmr_epr_common_utils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_epr_common_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod pw_pool_types.mod cell_types.mod pw_grid_types.mod pw_methods.mod base_hooks.mod mathconstants.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_energy_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_energy_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod scf_control_types.mod qs_rho_types.mod qs_mo_types.mod atprop_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod et_coupling_proj.mod kinds.mod qs_integrate_potential.mod qs_scf.mod cp_control_utils.mod qs_linres_module.mod cp_fm_struct.mod cp_external_control.mod xas_tdp_methods.mod qs_ks_methods.mod qs_tddfpt2_methods.mod xas_methods.mod et_coupling.mod mp2.mod base_hooks.mod kpoint_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_energy_utils.F qs_energy_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:29 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_energy_utils.mod' due to: qs_energy_utils.o /build/reproducible-path/cp2k-8.1/src/qs_energy_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kpoint_types.mod scf_control_types.mod qs_rho_types.mod qs_mo_types.mod atprop_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod pw_env_types.mod pw_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod et_coupling_proj.mod kinds.mod qs_integrate_potential.mod qs_scf.mod cp_control_utils.mod qs_linres_module.mod cp_fm_struct.mod cp_external_control.mod xas_tdp_methods.mod qs_ks_methods.mod qs_tddfpt2_methods.mod xas_methods.mod et_coupling.mod mp2.mod base_hooks.mod kpoint_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_epr_ownutils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_ownutils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod particle_types.mod qs_linres_types.mod pw_pool_types.mod atomic_kind_types.mod input_section_types.mod pw_methods.mod qs_core_energies.mod util.mod kinds.mod qs_harmonics_atom.mod cp_output_handling.mod message_passing.mod qs_grid_atom.mod qs_linres_op.mod mathlib.mod cp_log_handling.mod base_hooks.mod qs_linres_nmr_epr_common_utils.mod pw_spline_utils.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_ownutils.F qs_linres_epr_ownutils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:07:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_epr_ownutils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_epr_ownutils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_epr_ownutils.mod' due to: qs_linres_epr_ownutils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_ownutils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod particle_types.mod qs_linres_types.mod pw_pool_types.mod atomic_kind_types.mod input_section_types.mod pw_methods.mod qs_core_energies.mod util.mod kinds.mod qs_harmonics_atom.mod cp_output_handling.mod message_passing.mod qs_grid_atom.mod qs_linres_op.mod mathlib.mod cp_log_handling.mod base_hooks.mod qs_linres_nmr_epr_common_utils.mod pw_spline_utils.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_chebyshev.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod dm_ls_scf_types.mod input_section_types.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod machine.mod dm_ls_scf_qs.mod cp_output_handling.mod arnoldi_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F dm_ls_chebyshev.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_chebyshev.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_chebyshev.F90 +/build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F:370:100: + + 370 | gdensity(igrid, iwindow) = kernel_g(1)*aitchev_T(1, iwindow) + 2.0_dp*dummy2(iwindow) + | ^ +Warning: 'aitchev_t.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F:370:100: Warning: 'aitchev_t.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F:355:72: + + 355 | chev_Es_dos(igrid) = (chev_E(igrid) - interval_b)/interval_a + | ^ +Warning: 'interval_b' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F:355:72: Warning: 'interval_a' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_chebyshev.mod' due to: dm_ls_chebyshev.o /build/reproducible-path/cp2k-8.1/src/dm_ls_chebyshev.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod dm_ls_scf_types.mod input_section_types.mod mathconstants.mod cp_log_handling.mod kinds.mod base_hooks.mod machine.mod dm_ls_scf_qs.mod cp_output_handling.mod arnoldi_api.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_issc_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_issc_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_p_env_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_linres_methods.mod cp_fm_struct.mod qs_spin_orbit.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod cp_dbcsr_cp2k_link.mod qs_fermi_contact.mod particle_methods.mod memory_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod qs_elec_field.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_issc_utils.F qs_linres_issc_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:07:19 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_issc_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_issc_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_issc_utils.mod' due to: qs_linres_issc_utils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_issc_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod qs_p_env_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_linres_methods.mod cp_fm_struct.mod qs_spin_orbit.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod cp_dbcsr_cp2k_link.mod qs_fermi_contact.mod particle_methods.mod memory_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod qs_elec_field.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_scf_curvy.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_curvy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod mathlib.mod mathconstants.mod cp_log_handling.mod kinds.mod iterate_matrix.mod base_hooks.mod input_constants.mod machine.mod bibliography.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_curvy.F dm_ls_scf_curvy.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf_curvy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf_curvy.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_scf_curvy.mod' due to: dm_ls_scf_curvy.o /build/reproducible-path/cp2k-8.1/src/dm_ls_scf_curvy.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dm_ls_scf_types.mod mathlib.mod mathconstants.mod cp_log_handling.mod kinds.mod iterate_matrix.mod base_hooks.mod input_constants.mod machine.mod bibliography.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_epr_nablavks.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_nablavks.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod qs_oce_types.mod cp_para_types.mod qs_rho0_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_rho_atom_types.mod qs_linres_types.mod qs_local_rho_types.mod pw_poisson_types.mod pw_pool_types.mod external_potential_types.mod particle_list_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod qs_rho_atom_methods.mod pw_methods.mod mathconstants.mod qs_ks_methods.mod qs_gapw_densities.mod qs_vxc.mod qs_vxc_atom.mod util.mod kinds.mod pw_poisson_methods.mod qs_harmonics_atom.mod cp_output_handling.mod hartree_local_methods.mod qs_grid_atom.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_nablavks.F qs_linres_epr_nablavks.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:07:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_epr_nablavks.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_epr_nablavks.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_epr_nablavks.mod' due to: qs_linres_epr_nablavks.o /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_nablavks.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod qs_oce_types.mod cp_para_types.mod qs_rho0_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_rho_atom_types.mod qs_linres_types.mod qs_local_rho_types.mod pw_poisson_types.mod pw_pool_types.mod external_potential_types.mod particle_list_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod qs_rho_atom_methods.mod pw_methods.mod mathconstants.mod qs_ks_methods.mod qs_gapw_densities.mod qs_vxc.mod qs_vxc_atom.mod util.mod kinds.mod pw_poisson_methods.mod qs_harmonics_atom.mod cp_output_handling.mod hartree_local_methods.mod qs_grid_atom.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dm_ls_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/dm_ls_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod molecule_types.mod dm_ls_scf_types.mod transport_env_types.mod qs_environment_types.mod qs_diis_types.mod input_section_types.mod cp_control_types.mod pexsi_methods.mod cp_log_handling.mod kinds.mod arnoldi_api.mod bibliography.mod cp_external_control.mod dm_ls_scf_qs.mod dm_ls_scf_methods.mod mathlib.mod qs_scf_post_tb.mod iterate_matrix.mod dm_ls_chebyshev.mod qs_diis.mod dm_ls_scf_curvy.mod machine.mod transport.mod base_hooks.mod input_constants.mod qs_scf_post_gpw.mod pao_main.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/dm_ls_scf.F dm_ls_scf.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:37 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"dm_ls_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dm_ls_scf.F90 +/build/reproducible-path/cp2k-8.1/src/dm_ls_scf.F:631:63: + + 631 | extra_scf = maxscf_reached .OR. scf_converged + | ^ +Warning: 'scf_converged' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/dm_ls_scf.F:631:63: Warning: 'maxscf_reached' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dm_ls_scf.mod' due to: dm_ls_scf.o /build/reproducible-path/cp2k-8.1/src/dm_ls_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod molecule_types.mod dm_ls_scf_types.mod transport_env_types.mod qs_environment_types.mod qs_diis_types.mod input_section_types.mod cp_control_types.mod pexsi_methods.mod cp_log_handling.mod kinds.mod arnoldi_api.mod bibliography.mod cp_external_control.mod dm_ls_scf_qs.mod dm_ls_scf_methods.mod mathlib.mod qs_scf_post_tb.mod iterate_matrix.mod dm_ls_chebyshev.mod qs_diis.mod dm_ls_scf_curvy.mod machine.mod transport.mod base_hooks.mod input_constants.mod qs_scf_post_gpw.mod pao_main.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_polar_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_polar_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_p_env_types.mod cell_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_linres_types.mod force_env_types.mod cp_fm_types.mod cp_result_types.mod input_section_types.mod mathconstants.mod qs_linres_methods.mod cp_fm_struct.mod qs_matrix_pools.mod cp_result_methods.mod kinds.mod cp_output_handling.mod physcon.mod cp_fm_basic_linalg.mod bibliography.mod cp_log_handling.mod base_hooks.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_polar_utils.F qs_linres_polar_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:07:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_polar_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_polar_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_polar_utils.mod' due to: qs_linres_polar_utils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_polar_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_p_env_types.mod cell_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_linres_types.mod force_env_types.mod cp_fm_types.mod cp_result_types.mod input_section_types.mod mathconstants.mod qs_linres_methods.mod cp_fm_struct.mod qs_matrix_pools.mod cp_result_methods.mod kinds.mod cp_output_handling.mod physcon.mod cp_fm_basic_linalg.mod bibliography.mod cp_log_handling.mod base_hooks.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_energy.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_energy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_energy_types.mod qs_environment_methods.mod almo_scf.mod qs_energy_init.mod qs_energy_utils.mod qs_scf.mod qs_ks_methods.mod dm_ls_scf.mod lri_environment_methods.mod energy_corrections.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_energy.F qs_energy.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_energy.mod' due to: qs_energy.o /build/reproducible-path/cp2k-8.1/src/qs_energy.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_energy_types.mod qs_environment_methods.mod almo_scf.mod qs_energy_init.mod qs_energy_utils.mod qs_scf.mod qs_ks_methods.mod dm_ls_scf.mod lri_environment_methods.mod energy_corrections.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_nmr_shift.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_shift.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod pw_pool_types.mod atomic_kind_types.mod input_section_types.mod pw_grid_types.mod pw_methods.mod mathconstants.mod util.mod kinds.mod qs_harmonics_atom.mod cp_output_handling.mod message_passing.mod qs_grid_atom.mod qs_linres_op.mod mathlib.mod cp_log_handling.mod base_hooks.mod qs_linres_nmr_epr_common_utils.mod pw_spline_utils.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_shift.F qs_linres_nmr_shift.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:07:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_nmr_shift.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_nmr_shift.F90 -/build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_shift.F:267:70: - - 267 | n_nics, na, natom, natom_local, natom_tot, nkind, nnics_local, nr, nra, nspins, num_pe, & - | ^ -Warning: 'nnics_local' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_nmr_shift.mod' due to: qs_linres_nmr_shift.o /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_shift.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod pw_pool_types.mod atomic_kind_types.mod input_section_types.mod pw_grid_types.mod pw_methods.mod mathconstants.mod util.mod kinds.mod qs_harmonics_atom.mod cp_output_handling.mod message_passing.mod qs_grid_atom.mod qs_linres_op.mod mathlib.mod cp_log_handling.mod base_hooks.mod qs_linres_nmr_epr_common_utils.mod pw_spline_utils.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_force.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod input_section_types.mod qs_subsys_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod lri_environment_types.mod qs_scf_post_scf.mod cp_log_handling.mod dft_plus_u.mod kinds.mod xtb_matrices.mod cp_output_handling.mod se_core_matrix.mod qs_dftb_matrices.mod qs_rho_methods.mod rt_propagation_forces.mod cp_dbcsr_operations.mod message_passing.mod mulliken.mod cp_dbcsr_output.mod qs_ks_methods.mod qs_core_energies.mod qs_core_hamiltonian.mod qs_external_potential.mod se_core_core.mod energy_corrections.mod qs_energy.mod base_hooks.mod qs_environment_methods.mod efield_utils.mod input_constants.mod ri_environment_methods.mod qs_dftb_dispersion.mod admm_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_force.F qs_force.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_force.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_force.mod' due to: qs_force.o /build/reproducible-path/cp2k-8.1/src/qs_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_force_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod input_section_types.mod qs_subsys_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod lri_environment_types.mod qs_scf_post_scf.mod cp_log_handling.mod dft_plus_u.mod kinds.mod xtb_matrices.mod cp_output_handling.mod se_core_matrix.mod qs_dftb_matrices.mod qs_rho_methods.mod rt_propagation_forces.mod cp_dbcsr_operations.mod message_passing.mod mulliken.mod cp_dbcsr_output.mod qs_ks_methods.mod qs_core_energies.mod qs_core_hamiltonian.mod qs_external_potential.mod se_core_core.mod energy_corrections.mod qs_energy.mod base_hooks.mod qs_environment_methods.mod efield_utils.mod input_constants.mod ri_environment_methods.mod qs_dftb_dispersion.mod admm_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_epr_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_mo_types.mod cell_types.mod qs_kind_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod particle_types.mod qs_linres_types.mod pw_pool_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod mathconstants.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod physcon.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_utils.F qs_linres_epr_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:07:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_epr_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_epr_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_epr_utils.mod' due to: qs_linres_epr_utils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_epr_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_mo_types.mod cell_types.mod qs_kind_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod particle_types.mod qs_linres_types.mod pw_pool_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod mathconstants.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod physcon.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_pol_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_pol_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod ewald_pw_types.mod ewald_environment_types.mod fist_nonbond_env_types.mod multipole_types.mod cell_types.mod distribution_1d_types.mod particle_types.mod fist_energy_types.mod input_section_types.mod atomic_kind_types.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod ewalds_multipole.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_pol_scf.F fist_pol_scf.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_pol_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_pol_scf.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_pol_scf.mod' due to: fist_pol_scf.o /build/reproducible-path/cp2k-8.1/src/fist_pol_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod ewald_pw_types.mod ewald_environment_types.mod fist_nonbond_env_types.mod multipole_types.mod cell_types.mod distribution_1d_types.mod particle_types.mod fist_energy_types.mod input_section_types.mod atomic_kind_types.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod ewalds_multipole.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_nmr_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_linres_types.mod atomic_kind_types.mod scf_control_types.mod cp_control_types.mod input_section_types.mod pw_env_types.mod qs_environment_types.mod cell_types.mod particle_types.mod cp_parser_types.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod memory_utilities.mod qs_matrix_pools.mod kinds.mod cp_units.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_utils.F qs_linres_nmr_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:07:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_nmr_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_nmr_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_nmr_utils.mod' due to: qs_linres_nmr_utils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_nmr_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_linres_types.mod atomic_kind_types.mod scf_control_types.mod cp_control_types.mod input_section_types.mod pw_env_types.mod qs_environment_types.mod cell_types.mod particle_types.mod cp_parser_types.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod memory_utilities.mod qs_matrix_pools.mod kinds.mod cp_units.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mol_force.o' due to: /build/reproducible-path/cp2k-8.1/src/mol_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mol_force.F mol_force.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mol_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mol_force.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mol_force.mod' due to: mol_force.o /build/reproducible-path/cp2k-8.1/src/mol_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 force_field_kind_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_current_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_current_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod qs_p_env_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod qs_loc_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod input_constants.mod pw_methods.mod qs_linres_methods.mod cp_fm_struct.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod cp_array_utils.mod qs_loc_methods.mod cp_dbcsr_cp2k_link.mod particle_methods.mod memory_utilities.mod qs_linres_op.mod cp_log_handling.mod base_hooks.mod qs_operators_ao.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_current_utils.F qs_linres_current_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:07:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_current_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_current_utils.F90 -/build/reproducible-path/cp2k-8.1/src/qs_linres_current_utils.F:1152:56: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_intra_force.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_intra_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atprop_types.mod molecule_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod mol_force.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_intra_force.F fist_intra_force.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_intra_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_intra_force.F90 +/build/reproducible-path/cp2k-8.1/src/fist_intra_force.F:119:64: - 1152 | state_done(idir, istate_next) = .TRUE. - | ^ -Warning: 'istate_next' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_current_utils.mod' due to: qs_linres_current_utils.o /build/reproducible-path/cp2k-8.1/src/qs_linres_current_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod qs_p_env_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod qs_loc_types.mod pw_pool_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod input_constants.mod pw_methods.mod qs_linres_methods.mod cp_fm_struct.mod qs_matrix_pools.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod cp_array_utils.mod qs_loc_methods.mod cp_dbcsr_cp2k_link.mod particle_methods.mod memory_utilities.mod qs_linres_op.mod cp_log_handling.mod base_hooks.mod qs_operators_ao.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_linres_module.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_linres_module.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_p_env_types.mod qs_mo_types.mod qs_environment_types.mod cp_control_types.mod qs_linres_types.mod force_env_types.mod input_section_types.mod input_constants.mod qs_linres_methods.mod qs_rho_methods.mod qs_linres_epr_ownutils.mod qs_linres_current.mod qs_linres_issc_utils.mod qs_linres_epr_nablavks.mod cp_output_handling.mod qs_p_env_methods.mod qs_linres_polar_utils.mod bibliography.mod qs_linres_nmr_shift.mod qs_linres_epr_utils.mod qs_linres_op.mod cp_log_handling.mod base_hooks.mod qs_linres_nmr_utils.mod qs_mo_methods.mod qs_linres_current_utils.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_linres_module.F qs_linres_module.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:07:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_linres_module.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_linres_module.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_linres_module.mod' due to: qs_linres_module.o /build/reproducible-path/cp2k-8.1/src/qs_linres_module.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_p_env_types.mod qs_mo_types.mod qs_environment_types.mod cp_control_types.mod qs_linres_types.mod force_env_types.mod input_section_types.mod input_constants.mod qs_linres_methods.mod qs_rho_methods.mod qs_linres_epr_ownutils.mod qs_linres_current.mod qs_linres_issc_utils.mod qs_linres_epr_nablavks.mod cp_output_handling.mod qs_p_env_methods.mod qs_linres_polar_utils.mod bibliography.mod qs_linres_nmr_shift.mod qs_linres_epr_utils.mod qs_linres_op.mod cp_log_handling.mod base_hooks.mod qs_linres_nmr_utils.mod qs_mo_methods.mod qs_linres_current_utils.mod + 119 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: pv_a + | ^ +Warning: 'pv_a.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/fist_intra_force.F:119:64: Warning: 'pv_a.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/fist_intra_force.F:414:88: + + 414 | CALL get_pv_torsion(k1, k3, k4, t12, t32, t43, pv_a(:, :, index_d)) + | ^ +Warning: 'pv_a.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/fist_intra_force.F:118:66: + + 118 | REAL(KIND=dp), DIMENSION(:), POINTER :: ener_a + | ^ +Warning: 'ener_a.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/fist_intra_force.F:118:66: Warning: 'ener_a.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/fist_intra_force.F:387:71: + + 387 | ener_a(index_d) = ener_a(index_d) + energy*0.25_dp + | ^ +Warning: 'ener_a.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_intra_force.mod' due to: fist_intra_force.o /build/reproducible-path/cp2k-8.1/src/fist_intra_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atprop_types.mod molecule_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod mol_force.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_stda_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod qs_environment_types.mod cp_control_types.mod cp_log_handling.mod base_hooks.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_types.F qs_tddfpt2_stda_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:08:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_stda_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_stda_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_stda_types.mod' due to: qs_tddfpt2_stda_types.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod atomic_kind_types.mod qs_kind_types.mod qs_environment_types.mod cp_control_types.mod cp_log_handling.mod base_hooks.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'manybody_eam.o' due to: /build/reproducible-path/cp2k-8.1/src/manybody_eam.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pair_potential_types.mod fist_nonbond_env_types.mod particle_types.mod cell_types.mod fist_neighbor_list_types.mod mathlib.mod message_passing.mod kinds.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/manybody_eam.F manybody_eam.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_eam.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_eam.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'manybody_eam.mod' due to: manybody_eam.o /build/reproducible-path/cp2k-8.1/src/manybody_eam.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pair_potential_types.mod fist_nonbond_env_types.mod particle_types.mod cell_types.mod fist_neighbor_list_types.mod mathlib.mod message_passing.mod kinds.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_subgroups.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod molecule_kind_types.mod distribution_1d_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod molecule_types.mod task_list_types.mod input_constants.mod task_list_methods.mod cp_fm_struct.mod cp_blacs_env.mod distribution_methods.mod pw_env_methods.mod kinds.mod cp_dbcsr_operations.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_para_env.mod base_hooks.mod qs_neighbor_lists.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F qs_tddfpt2_subgroups.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:08:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_subgroups.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_subgroups.F90 -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_nonbond_force.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod atprop_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod fist_neighbor_list_types.mod ewald_environment_types.mod distribution_1d_types.mod pair_potential_types.mod shell_potential_types.mod splines_types.mod cp_log_handling.mod kinds.mod message_passing.mod mathlib.mod pair_potential_coulomb.mod splines_methods.mod machine.mod base_hooks.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F fist_nonbond_force.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:13:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_nonbond_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_nonbond_force.F90 +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:442:96: - 184 | TYPE(mgrid_saved_parameters) :: mgrid_saved - | ^ -Warning: 'mgrid_saved.relative_cutoff' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: Warning: 'mgrid_saved.progression_factor' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:491:44: + 442 | ei_interaction_cutoffs(2, kind_a, kind_b)) + | ^ +Warning: 'qcore_b' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:110:60: - 491 | qs_control%cutoff = mgrid_saved%cutoff - | ^ -Warning: 'mgrid_saved.cutoff' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: + 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & + | ^ +note: 'qcore_b' was declared here +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:399:96: - 184 | TYPE(mgrid_saved_parameters) :: mgrid_saved - | ^ -note: 'mgrid_saved.cutoff' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:490:78: + 399 | ei_interaction_cutoffs(1, kind_a, kind_b)) + | ^ +Warning: 'qcore_a' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:110:51: - 490 | qs_control%skip_load_balance_distributed = mgrid_saved%skip_load_balance - | ^ -Warning: 'MEM [(struct mgrid_saved_parameters *)&mgrid_saved + 8B]' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: + 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & + | ^ +note: 'qcore_a' was declared here +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:419:96: - 184 | TYPE(mgrid_saved_parameters) :: mgrid_saved - | ^ -note: 'MEM [(struct mgrid_saved_parameters *)&mgrid_saved + 8B]' was declared here -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: Warning: 'MEM [(struct mgrid_saved_parameters *)&mgrid_saved + 4B]' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F:184:71: Warning: 'MEM [(struct mgrid_saved_parameters *)&mgrid_saved]' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_subgroups.mod' due to: qs_tddfpt2_subgroups.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_subgroups.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod molecule_kind_types.mod distribution_1d_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod molecule_types.mod task_list_types.mod input_constants.mod task_list_methods.mod cp_fm_struct.mod cp_blacs_env.mod distribution_methods.mod pw_env_methods.mod kinds.mod cp_dbcsr_operations.mod message_passing.mod cp_dbcsr_cp2k_link.mod cp_para_env.mod base_hooks.mod qs_neighbor_lists.mod + 419 | ei_interaction_cutoffs(3, kind_a, kind_b)) + | ^ +Warning: 'qshell_b' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:110:96: + + 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & + | ^ +note: 'qshell_b' was declared here +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:419:96: + + 419 | ei_interaction_cutoffs(3, kind_a, kind_b)) + | ^ +Warning: 'qshell_a' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:110:86: + + 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & + | ^ +note: 'qshell_a' was declared here +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:478:96: + + 478 | ei_interaction_cutoffs(3, kind_a, kind_b)) + | ^ +Warning: 'qeff_b' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:110:76: + + 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & + | ^ +note: 'qeff_b' was declared here +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:460:96: + + 460 | ei_interaction_cutoffs(3, kind_a, kind_b)) + | ^ +Warning: 'qeff_a' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:110:68: + + 110 | fscalar, mm_radius_a, mm_radius_b, qcore_a, qcore_b, qeff_a, qeff_b, qshell_a, qshell_b, & + | ^ +note: 'qeff_a' was declared here +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:533:31: + + 533 | !$OMP ATOMIC + | ^ +Warning: 'shell_b' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:104:59: + + 104 | j, kind_a, kind_b, nkind, npairs, shell_a, shell_b, shell_type + | ^ +note: 'shell_b' was declared here +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:525:31: + + 525 | !$OMP ATOMIC + | ^ +Warning: 'shell_a' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F:104:50: + + 104 | j, kind_a, kind_b, nkind, npairs, shell_a, shell_b, shell_type + | ^ +note: 'shell_a' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_nonbond_force.mod' due to: fist_nonbond_force.o /build/reproducible-path/cp2k-8.1/src/fist_nonbond_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod atprop_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod fist_neighbor_list_types.mod ewald_environment_types.mod distribution_1d_types.mod pair_potential_types.mod shell_potential_types.mod splines_types.mod cp_log_handling.mod kinds.mod message_passing.mod mathlib.mod pair_potential_coulomb.mod splines_methods.mod machine.mod base_hooks.mod mathconstants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod cp_fm_pool_types.mod admm_types.mod qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod xc_rho_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod qs_tddfpt2_stda_types.mod xc_rho_cflags_types.mod pw_pool_types.mod cp_fm_types.mod ewald_pw_types.mod input_section_types.mod ewald_environment_types.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod qs_rho_methods.mod kinds.mod cp_fm_vect.mod qs_tddfpt2_subgroups.mod cp_dbcsr_operations.mod xc_derivatives.mod base_hooks.mod xc.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_types.F qs_tddfpt2_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:08:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_types.mod' due to: qs_tddfpt2_types.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod cp_fm_pool_types.mod admm_types.mod qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod xc_rho_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod qs_tddfpt2_stda_types.mod xc_rho_cflags_types.mod pw_pool_types.mod cp_fm_types.mod ewald_pw_types.mod input_section_types.mod ewald_environment_types.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod qs_rho_methods.mod kinds.mod cp_fm_vect.mod qs_tddfpt2_subgroups.mod cp_dbcsr_operations.mod xc_derivatives.mod base_hooks.mod xc.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_efield_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_efield_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_efield_types.mod fist_environment_types.mod cp_result_types.mod particle_types.mod cell_types.mod input_section_types.mod atomic_kind_types.mod cp_result_methods.mod mathconstants.mod kinds.mod base_hooks.mod physcon.mod moments_utils.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_efield_methods.F fist_efield_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_efield_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_efield_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_efield_methods.mod' due to: fist_efield_methods.o /build/reproducible-path/cp2k-8.1/src/fist_efield_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_efield_types.mod fist_environment_types.mod cp_result_types.mod particle_types.mod cell_types.mod input_section_types.mod atomic_kind_types.mod cp_result_methods.mod mathconstants.mod kinds.mod base_hooks.mod physcon.mod moments_utils.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xc_pot_saop.o' due to: /build/reproducible-path/cp2k-8.1/src/xc_pot_saop.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod qs_mo_types.mod qs_kind_types.mod xc_rho_set_types.mod qs_oce_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_local_rho_types.mod xc_rho_cflags_types.mod pw_pool_types.mod xc_derivative_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod input_constants.mod qs_rho_atom_methods.mod xc_xbecke88.mod pw_methods.mod mathconstants.mod qs_gapw_densities.mod qs_vxc_atom.mod util.mod kinds.mod qs_harmonics_atom.mod qs_integrate_potential.mod cp_array_utils.mod cp_dbcsr_operations.mod xc_derivatives.mod qs_collocate_density.mod qs_grid_atom.mod xc_atom.mod qs_ks_atom.mod base_hooks.mod xc.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xc_pot_saop.F xc_pot_saop.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:08:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xc_pot_saop.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xc_pot_saop.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xc_pot_saop.mod' due to: xc_pot_saop.o /build/reproducible-path/cp2k-8.1/src/xc_pot_saop.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod qs_mo_types.mod qs_kind_types.mod xc_rho_set_types.mod qs_oce_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod qs_rho_atom_types.mod qs_local_rho_types.mod xc_rho_cflags_types.mod pw_pool_types.mod xc_derivative_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod input_constants.mod qs_rho_atom_methods.mod xc_xbecke88.mod pw_methods.mod mathconstants.mod qs_gapw_densities.mod qs_vxc_atom.mod util.mod kinds.mod qs_harmonics_atom.mod qs_integrate_potential.mod cp_array_utils.mod cp_dbcsr_operations.mod xc_derivatives.mod qs_collocate_density.mod qs_grid_atom.mod xc_atom.mod qs_ks_atom.mod base_hooks.mod xc.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ewalds.o' due to: /build/reproducible-path/cp2k-8.1/src/ewalds.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod dg_rho0_types.mod atomic_kind_types.mod pw_grid_types.mod ewald_environment_types.mod distribution_1d_types.mod dg_types.mod ewald_pw_types.mod shell_potential_types.mod structure_factor_types.mod kinds.mod bibliography.mod message_passing.mod structure_factors.mod mathlib.mod base_hooks.mod mathconstants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ewalds.F ewalds.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ewalds.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ewalds.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ewalds.mod' due to: ewalds.o /build/reproducible-path/cp2k-8.1/src/ewalds.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod dg_rho0_types.mod atomic_kind_types.mod pw_grid_types.mod ewald_environment_types.mod distribution_1d_types.mod dg_types.mod ewald_pw_types.mod shell_potential_types.mod structure_factor_types.mod kinds.mod bibliography.mod message_passing.mod structure_factors.mod mathlib.mod base_hooks.mod mathconstants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cell_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_tddfpt2_types.mod qs_scf_types.mod cp_fm_types.mod input_section_types.mod input_constants.mod xtb_matrices.mod cp_gemm_interface.mod qs_ks_methods.mod qs_scf_post_gpw.mod cp_fm_struct.mod cp_blacs_env.mod util.mod kinds.mod xc_pot_saop.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod cp_array_utils.mod message_passing.mod cp_fm_cholesky.mod qs_scf_methods.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_utils.F qs_tddfpt2_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:08:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_utils.mod' due to: qs_tddfpt2_utils.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cell_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_tddfpt2_types.mod qs_scf_types.mod cp_fm_types.mod input_section_types.mod input_constants.mod xtb_matrices.mod cp_gemm_interface.mod qs_ks_methods.mod qs_scf_post_gpw.mod cp_fm_struct.mod cp_blacs_env.mod util.mod kinds.mod xc_pot_saop.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod cp_array_utils.mod message_passing.mod cp_fm_cholesky.mod qs_scf_methods.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pme.o' due to: /build/reproducible-path/cp2k-8.1/src/pme.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod atprop_types.mod dg_rho0_types.mod atomic_kind_types.mod pw_grid_types.mod ewald_environment_types.mod pw_types.mod dg_types.mod ewald_pw_types.mod shell_potential_types.mod structure_factor_types.mod realspace_grid_types.mod kinds.mod bibliography.mod structure_factors.mod pw_poisson_methods.mod dgs.mod pw_methods.mod base_hooks.mod mathconstants.mod pme_tools.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pme.F pme.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pme.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pme.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pme.mod' due to: pme.o /build/reproducible-path/cp2k-8.1/src/pme.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod atprop_types.mod dg_rho0_types.mod atomic_kind_types.mod pw_grid_types.mod ewald_environment_types.mod pw_types.mod dg_types.mod ewald_pw_types.mod shell_potential_types.mod structure_factor_types.mod realspace_grid_types.mod kinds.mod bibliography.mod structure_factors.mod pw_poisson_methods.mod dgs.mod pw_methods.mod base_hooks.mod mathconstants.mod pme_tools.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_densities.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_densities.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_environment_types.mod qs_ks_types.mod cp_fm_types.mod qs_tddfpt2_subgroups.mod base_hooks.mod cp_gemm_interface.mod qs_collocate_density.mod qs_rho_methods.mod cp_dbcsr_operations.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_densities.F qs_tddfpt2_densities.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:08:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_densities.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_densities.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_densities.mod' due to: qs_tddfpt2_densities.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_densities.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_environment_types.mod qs_ks_types.mod cp_fm_types.mod qs_tddfpt2_subgroups.mod base_hooks.mod cp_gemm_interface.mod qs_collocate_density.mod qs_rho_methods.mod cp_dbcsr_operations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'manybody_quip.o' due to: /build/reproducible-path/cp2k-8.1/src/manybody_quip.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pair_potential_types.mod fist_nonbond_env_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod cp_log_handling.mod kinds.mod base_hooks.mod physcon.mod bibliography.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/manybody_quip.F manybody_quip.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_quip.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_quip.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'manybody_quip.mod' due to: manybody_quip.o /build/reproducible-path/cp2k-8.1/src/manybody_quip.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pair_potential_types.mod fist_nonbond_env_types.mod particle_types.mod cell_types.mod atomic_kind_types.mod cp_log_handling.mod kinds.mod base_hooks.mod physcon.mod bibliography.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_operators.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_operators.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod admm_types.mod pw_types.mod xc_rho_set_types.mod pw_env_types.mod qs_environment_types.mod qs_tddfpt2_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod pw_methods.mod cp_gemm_interface.mod cp_fm_struct.mod hfx_admm_utils.mod kinds.mod pw_poisson_methods.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod base_hooks.mod xc.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_operators.F qs_tddfpt2_operators.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:08:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_operators.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_operators.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_operators.mod' due to: qs_tddfpt2_operators.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_operators.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod admm_types.mod pw_types.mod xc_rho_set_types.mod pw_env_types.mod qs_environment_types.mod qs_tddfpt2_types.mod pw_poisson_types.mod pw_pool_types.mod cp_fm_types.mod pw_methods.mod cp_gemm_interface.mod cp_fm_struct.mod hfx_admm_utils.mod kinds.mod pw_poisson_methods.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod base_hooks.mod xc.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'manybody_siepmann.o' due to: /build/reproducible-path/cp2k-8.1/src/manybody_siepmann.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pair_potential_types.mod fist_nonbond_env_types.mod particle_types.mod cell_types.mod input_section_types.mod fist_neighbor_list_types.mod atomic_kind_types.mod mathlib.mod message_passing.mod cp_log_handling.mod util.mod kinds.mod base_hooks.mod cp_output_handling.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/manybody_siepmann.F manybody_siepmann.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_siepmann.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_siepmann.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'manybody_siepmann.mod' due to: manybody_siepmann.o /build/reproducible-path/cp2k-8.1/src/manybody_siepmann.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pair_potential_types.mod fist_nonbond_env_types.mod particle_types.mod cell_types.mod input_section_types.mod fist_neighbor_list_types.mod atomic_kind_types.mod mathlib.mod message_passing.mod cp_log_handling.mod util.mod kinds.mod base_hooks.mod cp_output_handling.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_stda_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_tddfpt2_stda_types.mod qs_tddfpt2_types.mod atprop_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod ewald_pw_types.mod input_section_types.mod ewald_environment_types.mod mathconstants.mod cp_fm_diag.mod cp_fm_struct.mod util.mod kinds.mod qs_tddfpt2_subgroups.mod cp_dbcsr_operations.mod ewald_methods_tb.mod cp_fm_basic_linalg.mod message_passing.mod iterate_matrix.mod cp_dbcsr_cp2k_link.mod particle_methods.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_utils.F qs_tddfpt2_stda_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:08:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_stda_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_stda_utils.F90 -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_utils.F:183:39: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'manybody_tersoff.o' due to: /build/reproducible-path/cp2k-8.1/src/manybody_tersoff.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod fist_nonbond_env_types.mod cell_types.mod fist_neighbor_list_types.mod mathlib.mod util.mod mathconstants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/manybody_tersoff.F manybody_tersoff.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_tersoff.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_tersoff.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'manybody_tersoff.mod' due to: manybody_tersoff.o /build/reproducible-path/cp2k-8.1/src/manybody_tersoff.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pair_potential_types.mod fist_nonbond_env_types.mod cell_types.mod fist_neighbor_list_types.mod mathlib.mod util.mod mathconstants.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'manybody_gal.o' due to: /build/reproducible-path/cp2k-8.1/src/manybody_gal.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pair_potential_types.mod fist_nonbond_env_types.mod particle_types.mod cell_types.mod input_section_types.mod fist_neighbor_list_types.mod atomic_kind_types.mod mathlib.mod message_passing.mod cp_log_handling.mod util.mod kinds.mod base_hooks.mod cp_output_handling.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/manybody_gal.F manybody_gal.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_gal.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_gal.F90 +/build/reproducible-path/cp2k-8.1/src/manybody_gal.F:171:126: - 183 | cstring = "GAMMA EXCHANGE MATRIX" - | 1 -Warning: CHARACTER expression will be truncated in assignment (20/21) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_utils.F:343:47: + 171 | - gal%bxy*drji2*sinalpha*sinalpha)) + | ^ +Warning: 'sinalpha' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/manybody_gal.F:171:126: Warning: 'cosalpha' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/manybody_gal.F:172:33: - 343 | CALL copy_dbcsr_to_fm(sm_s, fm_s_half) - | ^ -Warning: 'sm_s' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_stda_utils.mod' due to: qs_tddfpt2_stda_utils.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_stda_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_tddfpt2_stda_types.mod qs_tddfpt2_types.mod atprop_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod ewald_pw_types.mod input_section_types.mod ewald_environment_types.mod mathconstants.mod cp_fm_diag.mod cp_fm_struct.mod util.mod kinds.mod qs_tddfpt2_subgroups.mod cp_dbcsr_operations.mod ewald_methods_tb.mod cp_fm_basic_linalg.mod message_passing.mod iterate_matrix.mod cp_dbcsr_cp2k_link.mod particle_methods.mod cp_log_handling.mod base_hooks.mod + 172 | IF (weight == 0 .AND. index_outfile > 0) WRITE (index_outfile, *) "Fermi 0" + | ^ +Warning: 'weight' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'manybody_gal.mod' due to: manybody_gal.o /build/reproducible-path/cp2k-8.1/src/manybody_gal.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pair_potential_types.mod fist_nonbond_env_types.mod particle_types.mod cell_types.mod input_section_types.mod fist_neighbor_list_types.mod atomic_kind_types.mod mathlib.mod message_passing.mod cp_log_handling.mod util.mod kinds.mod base_hooks.mod cp_output_handling.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_fhxc.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_fhxc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_environment_types.mod cp_control_types.mod qs_tddfpt2_stda_types.mod qs_tddfpt2_types.mod cp_fm_types.mod pw_methods.mod cp_gemm_interface.mod qs_rho_methods.mod kinds.mod qs_tddfpt2_operators.mod qs_tddfpt2_densities.mod qs_tddfpt2_subgroups.mod qs_integrate_potential.mod cp_dbcsr_operations.mod base_hooks.mod qs_tddfpt2_stda_utils.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_fhxc.F qs_tddfpt2_fhxc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:08:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_fhxc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_fhxc.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_fhxc.mod' due to: qs_tddfpt2_fhxc.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_fhxc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_environment_types.mod cp_control_types.mod qs_tddfpt2_stda_types.mod qs_tddfpt2_types.mod cp_fm_types.mod pw_methods.mod cp_gemm_interface.mod qs_rho_methods.mod kinds.mod qs_tddfpt2_operators.mod qs_tddfpt2_densities.mod qs_tddfpt2_subgroups.mod qs_integrate_potential.mod cp_dbcsr_operations.mod base_hooks.mod qs_tddfpt2_stda_utils.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'manybody_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/manybody_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod distribution_1d_types.mod input_section_types.mod pair_potential_types.mod fist_neighbor_list_types.mod kinds.mod manybody_quip.mod manybody_eam.mod message_passing.mod manybody_siepmann.mod mathlib.mod util.mod manybody_tersoff.mod base_hooks.mod manybody_gal.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/manybody_potential.F manybody_potential.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"manybody_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' manybody_potential.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'manybody_potential.mod' due to: manybody_potential.o /build/reproducible-path/cp2k-8.1/src/manybody_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod distribution_1d_types.mod input_section_types.mod pair_potential_types.mod fist_neighbor_list_types.mod kinds.mod manybody_quip.mod manybody_eam.mod message_passing.mod manybody_siepmann.mod mathlib.mod util.mod manybody_tersoff.mod base_hooks.mod manybody_gal.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_restart.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_restart.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_para_types.mod qs_tddfpt2_types.mod input_section_types.mod cp_fm_types.mod string_utilities.mod cp_log_handling.mod cp_files.mod message_passing.mod cp_output_handling.mod base_hooks.mod cp_blacs_env.mod cp_fm_basic_linalg.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_restart.F qs_tddfpt2_restart.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:08:51 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_restart.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_restart.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_restart.mod' due to: qs_tddfpt2_restart.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_restart.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_para_types.mod qs_tddfpt2_types.mod input_section_types.mod cp_fm_types.mod string_utilities.mod cp_log_handling.mod cp_files.mod message_passing.mod cp_output_handling.mod base_hooks.mod cp_blacs_env.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_force.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod fist_efield_types.mod cp_subsys_types.mod fist_environment_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod atprop_types.mod molecule_types.mod exclusion_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod ewald_environment_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod virial_types.mod ewald_pw_types.mod shell_potential_types.mod multipole_types.mod fist_energy_types.mod cp_log_handling.mod fist_pol_scf.mod kinds.mod fist_intra_force.mod spme.mod manybody_eam.mod cp_output_handling.mod message_passing.mod fist_neighbor_list_control.mod fist_nonbond_force.mod fist_efield_methods.mod ewalds.mod ewald_pw_methods.mod pme.mod manybody_potential.mod base_hooks.mod input_constants.mod ewalds_multipole.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_force.F fist_force.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_force.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_force.mod' due to: fist_force.o /build/reproducible-path/cp2k-8.1/src/fist_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod fist_efield_types.mod cp_subsys_types.mod fist_environment_types.mod particle_types.mod cell_types.mod pw_poisson_types.mod atprop_types.mod molecule_types.mod exclusion_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod ewald_environment_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod virial_types.mod ewald_pw_types.mod shell_potential_types.mod multipole_types.mod fist_energy_types.mod cp_log_handling.mod fist_pol_scf.mod kinds.mod fist_intra_force.mod spme.mod manybody_eam.mod cp_output_handling.mod message_passing.mod fist_neighbor_list_control.mod fist_nonbond_force.mod fist_efield_methods.mod ewalds.mod ewald_pw_methods.mod pme.mod manybody_potential.mod base_hooks.mod input_constants.mod ewalds_multipole.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_eigensolver.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_eigensolver.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_tddfpt2_types.mod cp_fm_types.mod input_section_types.mod input_constants.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod qs_tddfpt2_fhxc.mod cp_blacs_env.mod kinds.mod qs_tddfpt2_utils.mod qs_tddfpt2_operators.mod qs_tddfpt2_subgroups.mod cp_output_handling.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod qs_tddfpt2_restart.mod memory_utilities.mod qs_scf_methods.mod cp_log_handling.mod base_hooks.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_eigensolver.F qs_tddfpt2_eigensolver.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:08:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_eigensolver.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_eigensolver.F90 -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_eigensolver.F:390:25: - - 390 | IF (do_hfx .AND. .NOT. is_stda) THEN - | ^ -Warning: 'is_stda' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_eigensolver.F:321:93: - - 321 | LOGICAL :: do_admm, is_rks_triplets, is_stda - | ^ -note: 'is_stda' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_eigensolver.mod' due to: qs_tddfpt2_eigensolver.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_eigensolver.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod qs_tddfpt2_types.mod cp_fm_types.mod input_section_types.mod input_constants.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod qs_tddfpt2_fhxc.mod cp_blacs_env.mod kinds.mod qs_tddfpt2_utils.mod qs_tddfpt2_operators.mod qs_tddfpt2_subgroups.mod cp_output_handling.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod qs_tddfpt2_restart.mod memory_utilities.mod qs_scf_methods.mod cp_log_handling.mod base_hooks.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_links_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_links_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod particle_types.mod cp_log_handling.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_links_methods.F qmmm_links_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_links_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_links_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_links_methods.mod' due to: qmmm_links_methods.o /build/reproducible-path/cp2k-8.1/src/qmmm_links_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod particle_types.mod cp_log_handling.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_properties.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_properties.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_subsys_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_tddfpt2_types.mod pw_poisson_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod cp_cfm_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod string_utilities.mod mathconstants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod util.mod kinds.mod kahan_sum.mod molden_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod physcon.mod moments_utils.mod message_passing.mod qs_collocate_density.mod bibliography.mod cp_log_handling.mod base_hooks.mod dbcsr_vector.mod cp_realspace_grid_cube.mod qs_moments.mod qs_operators_ao.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_properties.F qs_tddfpt2_properties.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:08:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_properties.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_properties.F90 -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_properties.F:680:76: - - 680 | nmo_virt_occ_alpha = INT(nmo_virt(1), int_8)*INT(nmo_occ(1), int_8) - | ^ -Warning: 'nmo_virt[0]' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_properties.F:680:76: Warning: 'nmo_occ[0]' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_properties.F:654:72: - - 654 | weights_recv - | ^ -Warning: 'weights_recv.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_properties.mod' due to: qs_tddfpt2_properties.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_properties.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_subsys_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_tddfpt2_types.mod pw_poisson_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod cp_cfm_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod string_utilities.mod mathconstants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod util.mod kinds.mod kahan_sum.mod molden_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod physcon.mod moments_utils.mod message_passing.mod qs_collocate_density.mod bibliography.mod cp_log_handling.mod base_hooks.mod dbcsr_vector.mod cp_realspace_grid_cube.mod qs_moments.mod qs_operators_ao.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_force.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod fist_environment_types.mod qmmm_types_low.mod cp_result_types.mod particle_types.mod cell_types.mod qs_environment_types.mod qmmm_types.mod input_section_types.mod qs_energy_types.mod fist_energy_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod physcon.mod qs_ks_qmmm_methods.mod qmmm_util.mod cp_result_methods.mod qmmm_gpw_forces.mod qs_force.mod fist_force.mod base_hooks.mod qmmm_gpw_energy.mod qmmm_links_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_force.F qmmm_force.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_force.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_force.mod' due to: qmmm_force.o /build/reproducible-path/cp2k-8.1/src/qmmm_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod fist_environment_types.mod qmmm_types_low.mod cp_result_types.mod particle_types.mod cell_types.mod qs_environment_types.mod qmmm_types.mod input_section_types.mod qs_energy_types.mod fist_energy_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod physcon.mod qs_ks_qmmm_methods.mod qmmm_util.mod cp_result_methods.mod qmmm_gpw_forces.mod qs_force.mod fist_force.mod base_hooks.mod qmmm_gpw_energy.mod qmmm_links_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt2_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod admm_types.mod qs_mo_types.mod cell_types.mod qs_environment_types.mod cp_control_types.mod qs_tddfpt2_stda_types.mod qs_tddfpt2_types.mod qs_scf_types.mod cp_fm_types.mod input_section_types.mod input_constants.mod string_utilities.mod header.mod cp_blacs_env.mod kinds.mod qs_tddfpt2_utils.mod qs_tddfpt2_densities.mod qs_tddfpt2_subgroups.mod cp_output_handling.mod cp_dbcsr_operations.mod qs_tddfpt2_eigensolver.mod qs_tddfpt2_restart.mod bibliography.mod qs_scf_methods.mod cp_log_handling.mod base_hooks.mod qs_tddfpt2_properties.mod qs_tddfpt2_stda_utils.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_methods.F qs_tddfpt2_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:09:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt2_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt2_methods.F90 -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_methods.F:262:31: - - 262 | ALLOCATE (evals(nstates)) - | ^ -Warning: 'nstates' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_methods.F:393:13: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmmx_force.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmmx_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qmmm_types.mod cp_subsys_types.mod fist_environment_types.mod qmmm_types_low.mod qmmmx_types.mod particle_types.mod cell_types.mod input_section_types.mod qmmmx_util.mod kinds.mod input_constants.mod qmmm_force.mod qmmm_util.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmmx_force.F qmmmx_force.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_force.F90 +/build/reproducible-path/cp2k-8.1/src/qmmmx_force.F:134:70: - 393 | IF (do_admm) CALL tddfpt_release_kernel_env(kernel_env%admm_kernel) - | ^ -Warning: 'do_admm' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt2_methods.mod' due to: qs_tddfpt2_methods.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt2_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod admm_types.mod qs_mo_types.mod cell_types.mod qs_environment_types.mod cp_control_types.mod qs_tddfpt2_stda_types.mod qs_tddfpt2_types.mod qs_scf_types.mod cp_fm_types.mod input_section_types.mod input_constants.mod string_utilities.mod header.mod cp_blacs_env.mod kinds.mod qs_tddfpt2_utils.mod qs_tddfpt2_densities.mod qs_tddfpt2_subgroups.mod cp_output_handling.mod cp_dbcsr_operations.mod qs_tddfpt2_eigensolver.mod qs_tddfpt2_restart.mod bibliography.mod qs_scf_methods.mod cp_log_handling.mod base_hooks.mod qs_tddfpt2_properties.mod qs_tddfpt2_stda_utils.mod machine.mod + 134 | mom_conserv_n = COUNT(cur_labels >= mom_conserv_min_label) + | ^ +Warning: 'mom_conserv_min_label' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmmx_force.mod' due to: qmmmx_force.o /build/reproducible-path/cp2k-8.1/src/qmmmx_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qmmm_types.mod cp_subsys_types.mod fist_environment_types.mod qmmm_types_low.mod qmmmx_types.mod particle_types.mod cell_types.mod input_section_types.mod qmmmx_util.mod kinds.mod input_constants.mod qmmm_force.mod qmmm_util.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'et_coupling_proj.o' due to: /build/reproducible-path/cp2k-8.1/src/et_coupling_proj.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_subsys_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod physcon.mod qs_collocate_density.mod bibliography.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod cp_realspace_grid_cube.mod qs_mo_methods.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/et_coupling_proj.F et_coupling_proj.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:09:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"et_coupling_proj.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' et_coupling_proj.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'et_coupling_proj.mod' due to: et_coupling_proj.o /build/reproducible-path/cp2k-8.1/src/et_coupling_proj.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_types.mod qs_subsys_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod cp_gemm_interface.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod physcon.mod qs_collocate_density.mod bibliography.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod cp_realspace_grid_cube.mod qs_mo_methods.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'scine_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/scine_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_energy_types.mod particle_types.mod cell_types.mod force_env_types.mod kinds.mod physcon.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/scine_utils.F scine_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:24 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"scine_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' scine_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'scine_utils.mod' due to: scine_utils.o /build/reproducible-path/cp2k-8.1/src/scine_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_energy_types.mod particle_types.mod cell_types.mod force_env_types.mod kinds.mod physcon.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tp_scf.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tp_scf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod xas_env_types.mod qs_loc_types.mod qs_scf_types.mod qs_density_mixing_types.mod cp_fm_types.mod atomic_kind_types.mod qs_charges_types.mod scf_control_types.mod input_section_types.mod preconditioner_types.mod qs_ks_types.mod qs_energy_types.mod qs_ot_eigensolver.mod input_constants.mod qs_mixing_utils.mod qs_ks_methods.mod cp_blacs_env.mod qs_rho_methods.mod kinds.mod qs_scf_initialization.mod qs_scf_output.mod preconditioner.mod cp_external_control.mod cp_output_handling.mod cp_array_utils.mod qs_loc_methods.mod message_passing.mod xas_restart.mod qs_scf.mod particle_methods.mod qs_scf_methods.mod qs_scf_diagonalization.mod xas_control.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod qs_mo_methods.mod machine.mod qs_gspace_mixing.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tp_scf.F xas_tp_scf.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:09:16 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tp_scf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tp_scf.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tp_scf.mod' due to: xas_tp_scf.o /build/reproducible-path/cp2k-8.1/src/xas_tp_scf.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod xas_env_types.mod qs_loc_types.mod qs_scf_types.mod qs_density_mixing_types.mod cp_fm_types.mod atomic_kind_types.mod qs_charges_types.mod scf_control_types.mod input_section_types.mod preconditioner_types.mod qs_ks_types.mod qs_energy_types.mod qs_ot_eigensolver.mod input_constants.mod qs_mixing_utils.mod qs_ks_methods.mod cp_blacs_env.mod qs_rho_methods.mod kinds.mod qs_scf_initialization.mod qs_scf_output.mod preconditioner.mod cp_external_control.mod cp_output_handling.mod cp_array_utils.mod qs_loc_methods.mod message_passing.mod xas_restart.mod qs_scf.mod particle_methods.mod qs_scf_methods.mod qs_scf_diagonalization.mod xas_control.mod cp_log_handling.mod qs_mo_occupation.mod base_hooks.mod qs_mo_methods.mod machine.mod qs_gspace_mixing.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optimize_dmfet_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/optimize_dmfet_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod embed_types.mod qs_mo_types.mod cp_control_types.mod cp_fm_types.mod input_section_types.mod kinds.mod base_hooks.mod cp_gemm_interface.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/optimize_dmfet_potential.F optimize_dmfet_potential.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_dmfet_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_dmfet_potential.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optimize_dmfet_potential.mod' due to: optimize_dmfet_potential.o /build/reproducible-path/cp2k-8.1/src/optimize_dmfet_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod embed_types.mod qs_mo_types.mod cp_control_types.mod cp_fm_types.mod input_section_types.mod kinds.mod base_hooks.mod cp_gemm_interface.mod cp_blacs_env.mod cp_fm_struct.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod xas_env_types.mod qs_loc_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod input_constants.mod cp_gemm_interface.mod cp_fm_struct.mod qs_matrix_pools.mod kinds.mod qs_mo_io.mod qs_scf_initialization.mod cp_external_control.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_array_utils.mod physcon.mod qs_loc_methods.mod qs_pdos.mod ai_overlap.mod ai_contraction.mod xas_restart.mod cp_dbcsr_cp2k_link.mod qs_scf.mod particle_methods.mod memory_utilities.mod qs_diis.mod periodic_table.mod xas_control.mod cp_log_handling.mod base_hooks.mod xas_tp_scf.mod qs_loc_utils.mod qs_mo_methods.mod orbital_pointers.mod qs_operators_ao.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_methods.F xas_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:09:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_methods.mod' due to: xas_methods.o /build/reproducible-path/cp2k-8.1/src/xas_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod xas_env_types.mod qs_loc_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod input_constants.mod cp_gemm_interface.mod cp_fm_struct.mod qs_matrix_pools.mod kinds.mod qs_mo_io.mod qs_scf_initialization.mod cp_external_control.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_array_utils.mod physcon.mod qs_loc_methods.mod qs_pdos.mod ai_overlap.mod ai_contraction.mod xas_restart.mod cp_dbcsr_cp2k_link.mod qs_scf.mod particle_methods.mod memory_utilities.mod qs_diis.mod periodic_table.mod xas_control.mod cp_log_handling.mod base_hooks.mod xas_tp_scf.mod qs_loc_utils.mod qs_mo_methods.mod orbital_pointers.mod qs_operators_ao.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'restraint.o' due to: /build/reproducible-path/cp2k-8.1/src/restraint.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod molecule_types.mod force_env_types.mod particle_list_types.mod molecule_list_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod colvar_types.mod molecule_kind_types.mod message_passing.mod kinds.mod colvar_methods.mod constraint_fxd.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/restraint.F restraint.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"restraint.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' restraint.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'restraint.mod' due to: restraint.o /build/reproducible-path/cp2k-8.1/src/restraint.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod molecule_types.mod force_env_types.mod particle_list_types.mod molecule_list_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod colvar_types.mod molecule_kind_types.mod message_passing.mod kinds.mod colvar_methods.mod constraint_fxd.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_types.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod cp_para_types.mod qs_ot_types.mod qs_loc_types.mod cp_fm_types.mod input_section_types.mod input_constants.mod libint_2c_3c.mod cp_files.mod kinds.mod qs_harmonics_atom.mod cp_array_utils.mod physcon.mod libint_wrapper.mod cp_para_env.mod qs_grid_atom.mod memory_utilities.mod mathlib.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_types.F xas_tdp_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:09:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_types.mod' due to: xas_tdp_types.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod cp_para_types.mod qs_ot_types.mod qs_loc_types.mod cp_fm_types.mod input_section_types.mod input_constants.mod libint_2c_3c.mod cp_files.mod kinds.mod qs_harmonics_atom.mod cp_array_utils.mod physcon.mod libint_wrapper.mod cp_para_env.mod qs_grid_atom.mod memory_utilities.mod mathlib.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eip_silicon.o' due to: /build/reproducible-path/cp2k-8.1/src/eip_silicon.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod eip_environment_types.mod atomic_kind_list_types.mod cell_types.mod distribution_1d_types.mod particle_types.mod input_section_types.mod atomic_kind_types.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod physcon.mod cp_output_handling.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/eip_silicon.F eip_silicon.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:29 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eip_silicon.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eip_silicon.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eip_silicon.mod' due to: eip_silicon.o /build/reproducible-path/cp2k-8.1/src/eip_silicon.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod eip_environment_types.mod atomic_kind_list_types.mod cell_types.mod distribution_1d_types.mod particle_types.mod input_section_types.mod atomic_kind_types.mod message_passing.mod cp_log_handling.mod kinds.mod base_hooks.mod physcon.mod cp_output_handling.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_kernel.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_kernel.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod basis_set_types.mod cp_para_types.mod qs_kind_types.mod qs_environment_types.mod particle_types.mod xas_tdp_types.mod qs_integral_utils.mod message_passing.mod base_hooks.mod cp_dbcsr_operations.mod util.mod kinds.mod particle_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_kernel.F xas_tdp_kernel.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:09:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_kernel.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_kernel.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_kernel.mod' due to: xas_tdp_kernel.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_kernel.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 distribution_2d_types.mod basis_set_types.mod cp_para_types.mod qs_kind_types.mod qs_environment_types.mod particle_types.mod xas_tdp_types.mod qs_integral_utils.mod message_passing.mod base_hooks.mod cp_dbcsr_operations.mod util.mod kinds.mod particle_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'external_potential_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/external_potential_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod particle_list_types.mod force_env_types.mod cp_log_handling.mod kinds.mod force_fields_util.mod fparser.mod string_utilities.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/external_potential_methods.F external_potential_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"external_potential_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' external_potential_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'external_potential_methods.mod' due to: external_potential_methods.o /build/reproducible-path/cp2k-8.1/src/external_potential_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod particle_list_types.mod force_env_types.mod cp_log_handling.mod kinds.mod force_fields_util.mod fparser.mod string_utilities.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_correction.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_correction.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_mo_types.mod xas_tdp_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_types.mod cp_cfm_types.mod input_section_types.mod qs_ks_methods.mod cp_gemm_interface.mod cp_fm_diag.mod xas_tdp_kernel.mod cp_fm_struct.mod cp_blacs_env.mod cp_cfm_diag.mod hfx_admm_utils.mod util.mod kinds.mod cp_array_utils.mod cp_dbcsr_operations.mod physcon.mod message_passing.mod bibliography.mod admm_utils.mod cp_log_handling.mod base_hooks.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_correction.F xas_tdp_correction.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:09:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_correction.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_correction.F90 -/build/reproducible-path/cp2k-8.1/src/xas_tdp_correction.F:516:46: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'grrm_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/grrm_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_energy_types.mod particle_types.mod force_env_types.mod kinds.mod physcon.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/grrm_utils.F grrm_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"grrm_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' grrm_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'grrm_utils.mod' due to: grrm_utils.o /build/reproducible-path/cp2k-8.1/src/grrm_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_energy_types.mod particle_types.mod force_env_types.mod kinds.mod physcon.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_cdft_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod pw_pool_types.mod hirshfeld_types.mod mixed_cdft_types.mod cell_types.mod qs_cdft_types.mod force_env_types.mod global_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_grid_types.mod mixed_environment_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod pw_grids.mod cp_output_handling.mod cp_fm_struct.mod pw_env_methods.mod cp_dbcsr_operations.mod cube_utils.mod message_passing.mod cp_array_utils.mod cp_files.mod cp_realspace_grid_init.mod d3_poly.mod cp_blacs_env.mod base_hooks.mod gaussian_gridlevels.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F mixed_cdft_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_cdft_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_cdft_utils.F90 +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:981:69: - 516 | nbatch_occ = MAX(1, nblk_occ/batch_size) - | ^ -Warning: 'nblk_occ' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_correction.F:517:48: + 981 | mixed_cdft%sub_logger(i)%p%iter_info%project_name = c_val + | 1 +Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1567:42: - 517 | nbatch_virt = MAX(1, nblk_virt/batch_size) - | ^ -Warning: 'nblk_virt' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_correction.mod' due to: xas_tdp_correction.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_correction.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_mo_types.mod xas_tdp_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_types.mod cp_cfm_types.mod input_section_types.mod qs_ks_methods.mod cp_gemm_interface.mod cp_fm_diag.mod xas_tdp_kernel.mod cp_fm_struct.mod cp_blacs_env.mod cp_cfm_diag.mod hfx_admm_utils.mod util.mod kinds.mod cp_array_utils.mod cp_dbcsr_operations.mod physcon.mod message_passing.mod bibliography.mod admm_utils.mod cp_log_handling.mod base_hooks.mod machine.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_integrals.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_integrals.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod xas_tdp_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod qs_o3c_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod eri_mme_types.mod molecule_types.mod input_constants.mod libint_2c_3c.mod cp_blacs_env.mod cp_files.mod kinds.mod t_c_g0.mod cp_array_utils.mod cp_dbcsr_operations.mod qs_integral_utils.mod message_passing.mod libint_wrapper.mod eri_mme_integrate.mod particle_methods.mod ai_contraction_sphi.mod gamma.mod mathlib.mod base_hooks.mod generic_os_integrals.mod qs_neighbor_lists.mod constants_operator.mod orbital_pointers.mod cp_eri_mme_interface.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_integrals.F xas_tdp_integrals.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:10:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_integrals.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_integrals.F90 -/build/reproducible-path/cp2k-8.1/src/xas_tdp_integrals.F:486:96: + 1567 | nzeroed = nzeroed + 1 + | ^ +Warning: 'nzeroed' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1058:92: - 486 | !$OMP iabc,sabc,jset,kset,ncob,ncoc,sgfb,sgfc,egfb,egfc,sabc_ext,cpp_buffer,ccp_buffer) - | ^ -Warning: 'my_eps_screen' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_integrals.mod' due to: xas_tdp_integrals.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_integrals.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod xas_tdp_types.mod qs_kind_types.mod distribution_2d_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod particle_types.mod qs_o3c_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod eri_mme_types.mod molecule_types.mod input_constants.mod libint_2c_3c.mod cp_blacs_env.mod cp_files.mod kinds.mod t_c_g0.mod cp_array_utils.mod cp_dbcsr_operations.mod qs_integral_utils.mod message_passing.mod libint_wrapper.mod eri_mme_integrate.mod particle_methods.mod ai_contraction_sphi.mod gamma.mod mathlib.mod base_hooks.mod generic_os_integrals.mod qs_neighbor_lists.mod constants_operator.mod orbital_pointers.mod cp_eri_mme_interface.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod xas_tdp_types.mod qs_kind_types.mod xc_rho_set_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod input_section_types.mod input_constants.mod mathconstants.mod libint_2c_3c.mod cp_blacs_env.mod util.mod kinds.mod qs_harmonics_atom.mod spherical_harmonics.mod cp_dbcsr_operations.mod cp_array_utils.mod atom_operators.mod physcon.mod qs_integral_utils.mod message_passing.mod xc_derivatives.mod cp_dbcsr_cholesky.mod cp_para_env.mod qs_grid_atom.mod xc_atom.mod qs_overlap.mod particle_methods.mod lebedev.mod memory_utilities.mod ai_contraction_sphi.mod mathlib.mod cp_log_handling.mod xas_tdp_integrals.mod base_hooks.mod xc.mod orbital_transformation_matrices.mod orbital_pointers.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F xas_tdp_atom.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:10:19 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_atom.F90 -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:414:58: + 1058 | TYPE(cp_fm_p_type), DIMENSION(:, :), POINTER :: matrix_p_tmp, mixed_matrix_p_tmp, & + | ^ +Warning: 'mixed_matrix_p_tmp.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1058:92: Warning: 'mixed_matrix_p_tmp.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1056:69: - 414 | grid_atom%rad(1:new_nr) = grid_atom%rad(first_ir:nr) - | ^ -Warning: 'first_ir' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:396:68: + 1056 | TYPE(cp_1d_r_p_type), ALLOCATABLE, DIMENSION(:, :) :: occno_tmp + | ^ +Warning: 'occno_tmp.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1056:69: Warning: 'occno_tmp.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1058:72: - 396 | INTEGER :: first_ir, ir, llmax_p1, na, new_nr, nr - | ^ -note: 'first_ir' was declared here -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1132:63: + 1058 | TYPE(cp_fm_p_type), DIMENSION(:, :), POINTER :: matrix_p_tmp, mixed_matrix_p_tmp, & + | ^ +Warning: 'matrix_p_tmp.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1058:72: Warning: 'matrix_p_tmp.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1064:74: - 1132 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: dso - | ^ -Warning: 'dso.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:70: + 1064 | TYPE(dbcsr_p_type), DIMENSION(:, :), POINTER :: density_matrix, w_matrix + | ^ +Warning: 'density_matrix.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F:1064:74: Warning: 'density_matrix.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_cdft_utils.mod' due to: mixed_cdft_utils.o /build/reproducible-path/cp2k-8.1/src/mixed_cdft_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod pw_pool_types.mod hirshfeld_types.mod mixed_cdft_types.mod cell_types.mod qs_cdft_types.mod force_env_types.mod global_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_grid_types.mod mixed_environment_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod pw_grids.mod cp_output_handling.mod cp_fm_struct.mod pw_env_methods.mod cp_dbcsr_operations.mod cube_utils.mod message_passing.mod cp_array_utils.mod cp_files.mod cp_realspace_grid_init.mod d3_poly.mod cp_blacs_env.mod base_hooks.mod gaussian_gridlevels.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_cdft_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod pw_pool_types.mod hirshfeld_types.mod mixed_cdft_types.mod particle_types.mod cell_types.mod qs_cdft_types.mod qs_mo_types.mod force_env_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod mixed_environment_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod grid_api.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_realspace_grid_cube.mod qs_mo_methods.mod hirshfeld_methods.mod cp_fm_basic_linalg.mod cp_dbcsr_diag.mod memory_utilities.mod mathlib.mod util.mod cp_array_utils.mod pw_methods.mod machine.mod base_hooks.mod mixed_cdft_utils.mod ao_util.mod qs_mo_io.mod input_constants.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F mixed_cdft_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:14:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_cdft_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_cdft_methods.F90 +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:2034:40: - 1133 | REAL(dp), DIMENSION(:, :), POINTER :: dgr1, dgr2, ga, gr, ri_sphi_so, zet - | ^ -Warning: 'dgr2.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:70: Warning: 'dgr2.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:70: Warning: 'dgr2.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:70: Warning: 'dgr2.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:70: Warning: 'dgr2.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1228:85: + 2034 | metric(:, :) = metric(:, :)/4.0_dp + | ^ +Warning: 'density_matrix_diff.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1188:95: - 1228 | dgr2(:, iso_proc:iso_proc), nr, 1.0_dp, dso(:, :, dir), na) - | ^ -Warning: 'dgr2.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:64: + 1188 | TYPE(dbcsr_p_type), DIMENSION(:, :), POINTER :: density_matrix, density_matrix_diff, & + | ^ +note: 'density_matrix_diff.dim[1].ubound' was declared here +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1188:95: Warning: 'density_matrix_diff.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1188:95: Warning: 'density_matrix_diff.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1171:64: - 1133 | REAL(dp), DIMENSION(:, :), POINTER :: dgr1, dgr2, ga, gr, ri_sphi_so, zet + 1171 | INTEGER, ALLOCATABLE, DIMENSION(:, :) :: homo | ^ -Warning: 'dgr1.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:64: Warning: 'dgr1.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:64: Warning: 'dgr1.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:64: Warning: 'dgr1.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1133:64: Warning: 'dgr1.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1226:85: +Warning: 'homo.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1171:64: Warning: 'homo.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1171:64: Warning: 'homo.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1188:74: - 1226 | dgr1(:, iso_proc:iso_proc), nr, 0.0_dp, dso(:, :, dir), na) - | ^ -Warning: 'dgr1.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: + 1188 | TYPE(dbcsr_p_type), DIMENSION(:, :), POINTER :: density_matrix, density_matrix_diff, & + | ^ +Warning: 'density_matrix.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1509:84: - 1134 | REAL(dp), DIMENSION(:, :, :), POINTER :: dga1, dga2, rhoa, rhob - | ^ -Warning: 'dga2.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: 'dga2.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: 'dga2.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: 'dga2.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: 'dga2.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: 'dga2.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:70: Warning: 'dga2.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: + 1509 | density_matrix(jstate, ispin)%matrix, -1.0_dp, 1.0_dp) + | ^ +Warning: 'density_matrix.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:1188:74: - 1134 | REAL(dp), DIMENSION(:, :, :), POINTER :: dga1, dga2, rhoa, rhob - | ^ -Warning: 'dga1.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: 'dga1.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: 'dga1.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: 'dga1.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: 'dga1.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: 'dga1.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1134:64: Warning: 'dga1.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1315:68: + 1188 | TYPE(dbcsr_p_type), DIMENSION(:, :), POINTER :: density_matrix, density_matrix_diff, & + | ^ +Warning: 'density_matrix.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3449:13: - 1315 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: co, dsgf, pos - | ^ -Warning: 'dsgf.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1315:68: Warning: 'dsgf.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1315:68: Warning: 'dsgf.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1315:68: Warning: 'dsgf.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1553:37: + 3449 | IF (ANY(mask_send)) THEN + | ^ +Warning: 'mask_send.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:2764:80: - 1553 | IF (do_gga) dsgf = 0.0_dp - | ^ -Warning: 'dsgf.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1315:68: + 2764 | LOGICAL, DIMENSION(:), POINTER :: mask_recv, mask_send, touched + | ^ +note: 'mask_send.dim[0].ubound' was declared here +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3466:13: - 1315 | REAL(dp), ALLOCATABLE, DIMENSION(:, :, :) :: co, dsgf, pos - | ^ -note: 'dsgf.dim[0].ubound' was declared here -/build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F:1315:68: Warning: 'dsgf.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_atom.mod' due to: xas_tdp_atom.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_atom.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 xc_derivative_set_types.mod qs_rho_types.mod qs_neighbor_list_types.mod cell_types.mod xas_tdp_types.mod qs_kind_types.mod xc_rho_set_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod xc_rho_cflags_types.mod xc_derivative_types.mod input_section_types.mod input_constants.mod mathconstants.mod libint_2c_3c.mod cp_blacs_env.mod util.mod kinds.mod qs_harmonics_atom.mod spherical_harmonics.mod cp_dbcsr_operations.mod cp_array_utils.mod atom_operators.mod physcon.mod qs_integral_utils.mod message_passing.mod xc_derivatives.mod cp_dbcsr_cholesky.mod cp_para_env.mod qs_grid_atom.mod xc_atom.mod qs_overlap.mod particle_methods.mod lebedev.mod memory_utilities.mod ai_contraction_sphi.mod mathlib.mod cp_log_handling.mod xas_tdp_integrals.mod base_hooks.mod xc.mod orbital_transformation_matrices.mod orbital_pointers.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod xas_tdp_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_types.mod cp_cfm_types.mod preconditioner_types.mod qs_ot_eigensolver.mod input_constants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod xas_tdp_kernel.mod cp_fm_struct.mod cp_blacs_env.mod cp_cfm_diag.mod cp_dbcsr_diag.mod kinds.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod cp_dbcsr_cholesky.mod mathlib.mod cp_log_handling.mod base_hooks.mod qs_mo_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_utils.F xas_tdp_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:10:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_utils.mod' due to: xas_tdp_utils.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod xas_tdp_types.mod cp_para_types.mod qs_environment_types.mod cp_fm_types.mod cp_cfm_types.mod preconditioner_types.mod qs_ot_eigensolver.mod input_constants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod xas_tdp_kernel.mod cp_fm_struct.mod cp_blacs_env.mod cp_cfm_diag.mod cp_dbcsr_diag.mod kinds.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod cp_dbcsr_cholesky.mod mathlib.mod cp_log_handling.mod base_hooks.mod qs_mo_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xas_tdp_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod admm_types.mod parallel_rng_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod xas_tdp_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_loc_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod xas_tdp_correction.mod input_constants.mod cp_gemm_interface.mod xas_tdp_atom.mod cp_fm_diag.mod cp_fm_struct.mod xc_write_output.mod cp_blacs_env.mod cp_files.mod util.mod kinds.mod qs_interactions.mod xas_tdp_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod physcon.mod qs_loc_methods.mod qs_pdos.mod message_passing.mod xas_methods.mod libint_wrapper.mod admm_utils.mod particle_methods.mod memory_utilities.mod periodic_table.mod mathlib.mod cp_log_handling.mod xas_tdp_integrals.mod base_hooks.mod qs_loc_utils.mod input_cp2k_dft.mod qs_mo_methods.mod machine.mod qs_operators_ao.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F xas_tdp_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:11:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"xas_tdp_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xas_tdp_methods.F90 -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2514:26: + 3466 | IF (ANY(mask_recv)) THEN + | ^ +Warning: 'mask_recv.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:2764:69: - 2514 | nmo = SIZE(lr_evals) - | ^ -Warning: 'lr_evals.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2514:26: Warning: 'lr_evals.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2443:68: + 2764 | LOGICAL, DIMENSION(:), POINTER :: mask_recv, mask_send, touched + | ^ +note: 'mask_recv.dim[0].ubound' was declared here +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3401:97: - 2443 | REAL(dp), DIMENSION(:), POINTER :: lr_evals - | ^ -Warning: 'lr_evals.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2443:68: Warning: 'lr_evals.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2612:33: + 3401 | ALLOCATE (req_total(COUNT(mixed_cdft%dlb_control%recv_work_repl) + 2*COUNT(touched))) + | ^ +Warning: 'touched.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:2764:89: - 2612 | IF (nspins == 1 .AND. ndo_mo == 1) THEN - | ^ -Warning: 'nspins' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:1501:41: + 2764 | LOGICAL, DIMENSION(:), POINTER :: mask_recv, mask_send, touched + | ^ +note: 'touched.dim[0].ubound' was declared here +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:2830:93: - 1501 | ALLOCATE (my_mos(n_states, nspins)) - | ^ -Warning: 'n_states' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2056:27: + 2830 | REAL(bo(2, 1) - bo(1, 1) + 1, dp)) + | ^ +Warning: 'my_work_size' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:2309:44: - 2056 | nosc = SIZE(lr_evals) - | ^ -Warning: 'lr_evals.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2056:27: Warning: 'lr_evals.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2105:63: + 2309 | jatom, katom, my_work, my_work_size, natom, nforce_eval, nkind, np(3), npme, nthread, & + | ^ +note: 'my_work_size' was declared here +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: - 2105 | osc_str(:) = pref*2.0_dp/3.0_dp*lr_evals(:)*osc_str(:) - | ^ -Warning: 'lr_evals.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2105:63: Warning: 'lr_evals.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2054:28: + 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight + | ^ +Warning: 'weight.dim[2].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3877:61: - 2054 | ndo_so = ndo_mo*nspins - | ^ -Warning: 'nspins' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2170:27: + 3877 | DO i = LBOUND(weight, 3), UBOUND(weight, 3) + | ^ +Warning: 'weight.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: - 2170 | nosc = SIZE(lr_evals) - | ^ -Warning: 'lr_evals.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2170:27: Warning: 'lr_evals.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2229:100: + 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight + | ^ +note: 'weight.dim[2].lbound' was declared here +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3877:61: - 2229 | osc_str(:) = pref*1._dp/20._dp*a_fine**2*lr_evals(:)**3*(osc_str(:) - 1._dp/3._dp*trace(:)**2) - | ^ -Warning: 'lr_evals.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2229:100: Warning: 'lr_evals.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F:2168:28: + 3877 | DO i = LBOUND(weight, 3), UBOUND(weight, 3) + | ^ +Warning: 'weight.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: - 2168 | ndo_so = ndo_mo*nspins - | ^ -Warning: 'nspins' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'xas_tdp_methods.mod' due to: xas_tdp_methods.o /build/reproducible-path/cp2k-8.1/src/xas_tdp_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod admm_types.mod parallel_rng_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod xas_tdp_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_loc_types.mod qs_scf_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod xas_tdp_correction.mod input_constants.mod cp_gemm_interface.mod xas_tdp_atom.mod cp_fm_diag.mod cp_fm_struct.mod xc_write_output.mod cp_blacs_env.mod cp_files.mod util.mod kinds.mod qs_interactions.mod xas_tdp_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod physcon.mod qs_loc_methods.mod qs_pdos.mod message_passing.mod xas_methods.mod libint_wrapper.mod admm_utils.mod particle_methods.mod memory_utilities.mod periodic_table.mod mathlib.mod cp_log_handling.mod xas_tdp_integrals.mod base_hooks.mod qs_loc_utils.mod input_cp2k_dft.mod qs_mo_methods.mod machine.mod qs_operators_ao.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_energy_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_energy_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod qs_mo_types.mod kpoint_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod atprop_types.mod cp_fm_types.mod scf_control_types.mod input_section_types.mod qs_energy_types.mod qs_ks_methods.mod cp_fm_struct.mod kinds.mod et_coupling.mod mp2.mod qs_linres_module.mod cp_control_utils.mod kpoint_methods.mod cp_external_control.mod qs_integrate_potential.mod qs_tddfpt2_methods.mod et_coupling_proj.mod xas_methods.mod qs_scf.mod base_hooks.mod xas_tdp_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_energy_utils.F qs_energy_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:11:19 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_energy_utils.mod' due to: qs_energy_utils.o /build/reproducible-path/cp2k-8.1/src/qs_energy_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_neighbor_list_types.mod qs_mo_types.mod kpoint_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod atprop_types.mod cp_fm_types.mod scf_control_types.mod input_section_types.mod qs_energy_types.mod qs_ks_methods.mod cp_fm_struct.mod kinds.mod et_coupling.mod mp2.mod qs_linres_module.mod cp_control_utils.mod kpoint_methods.mod cp_external_control.mod qs_integrate_potential.mod qs_tddfpt2_methods.mod et_coupling_proj.mod xas_methods.mod qs_scf.mod base_hooks.mod xas_tdp_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_energy.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_energy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_energy_types.mod energy_corrections.mod qs_scf.mod base_hooks.mod qs_ks_methods.mod dm_ls_scf.mod qs_energy_init.mod qs_environment_methods.mod almo_scf.mod qs_energy_utils.mod lri_environment_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_energy.F qs_energy.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:11:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_energy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_energy.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_energy.mod' due to: qs_energy.o /build/reproducible-path/cp2k-8.1/src/qs_energy.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_energy_types.mod energy_corrections.mod qs_scf.mod base_hooks.mod qs_ks_methods.mod dm_ls_scf.mod qs_energy_init.mod qs_environment_methods.mod almo_scf.mod qs_energy_utils.mod lri_environment_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagation_forces.o' due to: /build/reproducible-path/cp2k-8.1/src/rt_propagation_forces.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_neighbor_list_types.mod qs_mo_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod qs_force_types.mod qs_ks_types.mod mathconstants.mod cp_gemm_interface.mod cp_fm_struct.mod kinds.mod cp_fm_vect.mod cp_dbcsr_operations.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/rt_propagation_forces.F rt_propagation_forces.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:11:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"rt_propagation_forces.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_forces.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagation_forces.mod' due to: rt_propagation_forces.o /build/reproducible-path/cp2k-8.1/src/rt_propagation_forces.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_neighbor_list_types.mod qs_mo_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod qs_force_types.mod qs_ks_types.mod mathconstants.mod cp_gemm_interface.mod cp_fm_struct.mod kinds.mod cp_fm_vect.mod cp_dbcsr_operations.mod cp_dbcsr_cp2k_link.mod qs_overlap.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_force.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_rho_types.mod qs_subsys_types.mod qs_mo_types.mod lri_environment_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod qs_energy_types.mod admm_methods.mod input_constants.mod ri_environment_methods.mod qs_energy.mod se_core_matrix.mod qs_ks_methods.mod qs_dftb_matrices.mod xtb_matrices.mod mulliken.mod qs_core_energies.mod qs_rho_methods.mod kinds.mod qs_external_potential.mod qs_core_hamiltonian.mod energy_corrections.mod rt_propagation_forces.mod qs_environment_methods.mod efield_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod se_core_core.mod message_passing.mod cp_log_handling.mod cp_dbcsr_output.mod qs_scf_post_scf.mod base_hooks.mod qs_dftb_dispersion.mod dft_plus_u.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_force.F qs_force.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:11:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_force.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_force.mod' due to: qs_force.o /build/reproducible-path/cp2k-8.1/src/qs_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_rho_types.mod qs_subsys_types.mod qs_mo_types.mod lri_environment_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_force_types.mod qs_ks_types.mod qs_energy_types.mod admm_methods.mod input_constants.mod ri_environment_methods.mod qs_energy.mod se_core_matrix.mod qs_ks_methods.mod qs_dftb_matrices.mod xtb_matrices.mod mulliken.mod qs_core_energies.mod qs_rho_methods.mod kinds.mod qs_external_potential.mod qs_core_hamiltonian.mod energy_corrections.mod rt_propagation_forces.mod qs_environment_methods.mod efield_utils.mod cp_output_handling.mod cp_dbcsr_operations.mod se_core_core.mod message_passing.mod cp_log_handling.mod cp_dbcsr_output.mod qs_scf_post_scf.mod base_hooks.mod qs_dftb_dispersion.mod dft_plus_u.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_force.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_energy_types.mod fist_environment_types.mod cell_types.mod qs_environment_types.mod particle_types.mod cp_subsys_types.mod cp_result_types.mod input_section_types.mod qmmm_types_low.mod qmmm_types.mod qs_energy_types.mod qs_ks_qmmm_methods.mod qmmm_links_methods.mod cp_result_methods.mod kinds.mod qmmm_util.mod qmmm_gpw_energy.mod cp_output_handling.mod physcon.mod fist_force.mod cp_log_handling.mod base_hooks.mod qmmm_gpw_forces.mod qs_force.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_force.F qmmm_force.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:11:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_force.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_force.mod' due to: qmmm_force.o /build/reproducible-path/cp2k-8.1/src/qmmm_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fist_energy_types.mod fist_environment_types.mod cell_types.mod qs_environment_types.mod particle_types.mod cp_subsys_types.mod cp_result_types.mod input_section_types.mod qmmm_types_low.mod qmmm_types.mod qs_energy_types.mod qs_ks_qmmm_methods.mod qmmm_links_methods.mod cp_result_methods.mod kinds.mod qmmm_util.mod qmmm_gpw_energy.mod cp_output_handling.mod physcon.mod fist_force.mod cp_log_handling.mod base_hooks.mod qmmm_gpw_forces.mod qs_force.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmmx_force.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmmx_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmmx_types.mod input_section_types.mod qmmm_types_low.mod cp_subsys_types.mod fist_environment_types.mod qmmm_types.mod qs_environment_types.mod cell_types.mod particle_types.mod qmmmx_util.mod input_constants.mod qmmm_force.mod base_hooks.mod kinds.mod qmmm_util.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmmx_force.F qmmmx_force.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:11:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_force.F90 -/build/reproducible-path/cp2k-8.1/src/qmmmx_force.F:134:70: + 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight + | ^ +note: 'weight.dim[2].stride' was declared here +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: 'weight.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3829:58: - 134 | mom_conserv_n = COUNT(cur_labels >= mom_conserv_min_label) - | ^ -Warning: 'mom_conserv_min_label' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmmx_force.mod' due to: qmmmx_force.o /build/reproducible-path/cp2k-8.1/src/qmmmx_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmmx_types.mod input_section_types.mod qmmm_types_low.mod cp_subsys_types.mod fist_environment_types.mod qmmm_types.mod qs_environment_types.mod cell_types.mod particle_types.mod qmmmx_util.mod input_constants.mod qmmm_force.mod base_hooks.mod kinds.mod qmmm_util.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eip_silicon.o' due to: /build/reproducible-path/cp2k-8.1/src/eip_silicon.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod input_section_types.mod particle_types.mod eip_environment_types.mod cp_subsys_types.mod cell_types.mod atomic_kind_list_types.mod distribution_1d_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/eip_silicon.F eip_silicon.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:11:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eip_silicon.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eip_silicon.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eip_silicon.mod' due to: eip_silicon.o /build/reproducible-path/cp2k-8.1/src/eip_silicon.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod cp_para_types.mod input_section_types.mod particle_types.mod eip_environment_types.mod cp_subsys_types.mod cell_types.mod atomic_kind_list_types.mod distribution_1d_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optimize_dmfet_potential.o' due to: /build/reproducible-path/cp2k-8.1/src/optimize_dmfet_potential.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod cp_para_types.mod input_section_types.mod qs_mo_types.mod qs_environment_types.mod embed_types.mod cp_fm_types.mod base_hooks.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/optimize_dmfet_potential.F optimize_dmfet_potential.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_dmfet_potential.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_dmfet_potential.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optimize_dmfet_potential.mod' due to: optimize_dmfet_potential.o /build/reproducible-path/cp2k-8.1/src/optimize_dmfet_potential.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod cp_para_types.mod input_section_types.mod qs_mo_types.mod qs_environment_types.mod embed_types.mod cp_fm_types.mod base_hooks.mod cp_gemm_interface.mod cp_fm_struct.mod cp_blacs_env.mod cp_dbcsr_operations.mod kinds.mod + 3829 | DO j = LBOUND(weight, 2), UBOUND(weight, 2) + | ^ +Warning: 'weight.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: + + 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight + | ^ +note: 'weight.dim[1].lbound' was declared here +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3829:58: + + 3829 | DO j = LBOUND(weight, 2), UBOUND(weight, 2) + | ^ +Warning: 'weight.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: + + 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight + | ^ +note: 'weight.dim[1].stride' was declared here +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: 'weight.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: 'weight.dim[0].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: 'weight.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:74: Warning: 'weight.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: + + 3555 | REAL(KIND=dp), DIMENSION(:, :, :, :), POINTER :: gradients + | ^ +Warning: 'gradients.dim[3].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: Warning: 'gradients.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: Warning: 'gradients.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: Warning: 'gradients.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3555:69: Warning: 'gradients.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:66: + + 3554 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cavity, weight + | ^ +Warning: 'cavity.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:66: Warning: 'cavity.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:66: Warning: 'cavity.dim[0].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3554:66: Warning: 'cavity.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3549:68: + + 3549 | REAL(kind=dp), ALLOCATABLE, DIMENSION(:, :, :) :: dP_i_dRj + | ^ +Warning: 'dp_i_drj.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3549:68: Warning: 'dp_i_drj.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3891:41: + + 3891 | dP_i_dRi = 0.0_dp + | ^ +Warning: 'dp_i_dri.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3548:83: + + 3548 | distance_vecs, dP_i_dRi + | ^ +note: 'dp_i_dri.dim[1].ubound' was declared here +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3889:44: + + 3889 | d_sum_Pm_dR = 0.0_dp + | ^ +Warning: 'd_sum_pm_dr.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3547:87: + + 3547 | REAL(kind=dp), ALLOCATABLE, DIMENSION(:, :) :: d_sum_const_dR, d_sum_Pm_dR, & + | ^ +note: 'd_sum_pm_dr.dim[1].ubound' was declared here +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3890:47: + + 3890 | d_sum_const_dR = 0.0_dp + | ^ +Warning: 'd_sum_const_dr.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F:3547:74: + + 3547 | REAL(kind=dp), ALLOCATABLE, DIMENSION(:, :) :: d_sum_const_dR, d_sum_Pm_dR, & + | ^ +note: 'd_sum_const_dr.dim[1].ubound' was declared here +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_cdft_methods.mod' due to: mixed_cdft_methods.o /build/reproducible-path/cp2k-8.1/src/mixed_cdft_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod pw_pool_types.mod hirshfeld_types.mod mixed_cdft_types.mod particle_types.mod cell_types.mod qs_cdft_types.mod qs_mo_types.mod force_env_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod mixed_environment_types.mod pw_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod realspace_grid_types.mod cp_log_handling.mod kinds.mod grid_api.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod cp_realspace_grid_cube.mod qs_mo_methods.mod hirshfeld_methods.mod cp_fm_basic_linalg.mod cp_dbcsr_diag.mod memory_utilities.mod mathlib.mod util.mod cp_array_utils.mod pw_methods.mod machine.mod base_hooks.mod mixed_cdft_utils.mod ao_util.mod qs_mo_io.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'scine_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/scine_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod qs_environment_types.mod force_env_types.mod cell_types.mod particle_types.mod qs_energy_types.mod base_hooks.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/scine_utils.F scine_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"scine_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' scine_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'scine_utils.mod' due to: scine_utils.o /build/reproducible-path/cp2k-8.1/src/scine_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod qs_environment_types.mod force_env_types.mod cell_types.mod particle_types.mod qs_energy_types.mod base_hooks.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint_util.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod molecule_kind_types.mod virial_types.mod mathlib.mod message_passing.mod kinds.mod base_hooks.mod colvar_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/constraint_util.F constraint_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint_util.mod' due to: constraint_util.o /build/reproducible-path/cp2k-8.1/src/constraint_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod molecule_kind_types.mod virial_types.mod mathlib.mod message_passing.mod kinds.mod base_hooks.mod colvar_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'external_potential_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/external_potential_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod fparser.mod force_fields_util.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/external_potential_methods.F external_potential_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"external_potential_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' external_potential_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'external_potential_methods.mod' due to: external_potential_methods.o /build/reproducible-path/cp2k-8.1/src/external_potential_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod string_utilities.mod cp_log_handling.mod base_hooks.mod fparser.mod force_fields_util.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint_clv.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint_clv.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod particle_types.mod cell_types.mod colvar_types.mod input_section_types.mod molecule_kind_types.mod mathlib.mod kinds.mod colvar_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/constraint_clv.F constraint_clv.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_clv.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_clv.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint_clv.mod' due to: constraint_clv.o /build/reproducible-path/cp2k-8.1/src/constraint_clv.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod particle_types.mod cell_types.mod colvar_types.mod input_section_types.mod molecule_kind_types.mod mathlib.mod kinds.mod colvar_methods.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint_4x6.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint_4x6.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod particle_types.mod linear_systems.mod mathlib.mod base_hooks.mod constraint_fxd.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint_4x6.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint_4x6.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod particle_types.mod molecule_kind_types.mod atomic_kind_types.mod mathlib.mod kinds.mod base_hooks.mod constraint_fxd.mod linear_systems.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/constraint_4x6.F constraint_4x6.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_4x6.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_4x6.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint_4x6.mod' due to: constraint_4x6.o /build/reproducible-path/cp2k-8.1/src/constraint_4x6.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod particle_types.mod linear_systems.mod mathlib.mod base_hooks.mod constraint_fxd.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_4x6.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_4x6.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint_4x6.mod' due to: constraint_4x6.o /build/reproducible-path/cp2k-8.1/src/constraint_4x6.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod particle_types.mod molecule_kind_types.mod atomic_kind_types.mod mathlib.mod kinds.mod base_hooks.mod constraint_fxd.mod linear_systems.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint_clv.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint_clv.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod input_section_types.mod colvar_types.mod cell_types.mod particle_types.mod mathlib.mod base_hooks.mod colvar_methods.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/constraint_clv.F constraint_clv.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:19 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_clv.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_clv.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint_clv.mod' due to: constraint_clv.o /build/reproducible-path/cp2k-8.1/src/constraint_clv.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod input_section_types.mod colvar_types.mod cell_types.mod particle_types.mod mathlib.mod base_hooks.mod colvar_methods.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint_3x3.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint_3x3.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod particle_types.mod linear_systems.mod mathlib.mod base_hooks.mod constraint_fxd.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint_3x3.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint_3x3.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod particle_types.mod molecule_kind_types.mod atomic_kind_types.mod mathlib.mod kinds.mod base_hooks.mod constraint_fxd.mod linear_systems.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/constraint_3x3.F constraint_3x3.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_3x3.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_3x3.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint_3x3.mod' due to: constraint_3x3.o /build/reproducible-path/cp2k-8.1/src/constraint_3x3.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod particle_types.mod linear_systems.mod mathlib.mod base_hooks.mod constraint_fxd.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_3x3.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_3x3.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint_3x3.mod' due to: constraint_3x3.o /build/reproducible-path/cp2k-8.1/src/constraint_3x3.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod particle_types.mod molecule_kind_types.mod atomic_kind_types.mod mathlib.mod kinds.mod base_hooks.mod constraint_fxd.mod linear_systems.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint_util.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod particle_types.mod virial_types.mod cell_types.mod distribution_1d_types.mod mathlib.mod base_hooks.mod message_passing.mod colvar_methods.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/constraint_util.F constraint_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint_util.mod' due to: constraint_util.o /build/reproducible-path/cp2k-8.1/src/constraint_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod particle_types.mod virial_types.mod cell_types.mod distribution_1d_types.mod mathlib.mod base_hooks.mod message_passing.mod colvar_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint_vsite.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint_vsite.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod molecule_types.mod particle_list_types.mod molecule_list_types.mod particle_types.mod distribution_1d_types.mod force_env_types.mod molecule_kind_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/constraint_vsite.F constraint_vsite.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint_vsite.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint_vsite.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint_vsite.mod' due to: constraint_vsite.o /build/reproducible-path/cp2k-8.1/src/constraint_vsite.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod molecule_types.mod particle_list_types.mod molecule_list_types.mod particle_types.mod distribution_1d_types.mod force_env_types.mod molecule_kind_types.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod simpar_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod colvar_types.mod molecule_types.mod input_constants.mod kinds.mod constraint_4x6.mod constraint_clv.mod constraint_vsite.mod message_passing.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod constraint_3x3.mod constraint_util.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'constraint.o' due to: /build/reproducible-path/cp2k-8.1/src/constraint.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod colvar_types.mod molecule_types.mod atomic_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod simpar_types.mod cp_log_handling.mod kinds.mod message_passing.mod constraint_clv.mod constraint_4x6.mod memory_utilities.mod constraint_3x3.mod constraint_util.mod constraint_vsite.mod base_hooks.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/constraint.F constraint.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint.mod' due to: constraint.o /build/reproducible-path/cp2k-8.1/src/constraint.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod particle_types.mod molecule_kind_types.mod simpar_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod colvar_types.mod molecule_types.mod input_constants.mod kinds.mod constraint_4x6.mod constraint_clv.mod constraint_vsite.mod message_passing.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod constraint_3x3.mod constraint_util.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:24 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"constraint.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' constraint.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'constraint.mod' due to: constraint.o /build/reproducible-path/cp2k-8.1/src/constraint.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod colvar_types.mod molecule_types.mod atomic_kind_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod simpar_types.mod cp_log_handling.mod kinds.mod message_passing.mod constraint_clv.mod constraint_4x6.mod memory_utilities.mod constraint_3x3.mod constraint_util.mod constraint_vsite.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_env_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/force_env_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod molecule_list_types.mod molecule_types.mod force_env_types.mod input_section_types.mod particle_types.mod cp_subsys_types.mod particle_list_types.mod cell_types.mod atomic_kind_list_types.mod distribution_1d_types.mod base_hooks.mod constraint.mod constraint_util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_env_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/force_env_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod input_section_types.mod molecule_types.mod particle_list_types.mod molecule_list_types.mod atomic_kind_list_types.mod cell_types.mod particle_types.mod distribution_1d_types.mod force_env_types.mod kinds.mod constraint_util.mod constraint.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/force_env_utils.F force_env_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_env_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_env_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_env_utils.mod' due to: force_env_utils.o /build/reproducible-path/cp2k-8.1/src/force_env_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod molecule_list_types.mod molecule_types.mod force_env_types.mod input_section_types.mod particle_types.mod cp_subsys_types.mod particle_list_types.mod cell_types.mod atomic_kind_list_types.mod distribution_1d_types.mod base_hooks.mod constraint.mod constraint_util.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_env_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_env_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_env_utils.mod' due to: force_env_utils.o /build/reproducible-path/cp2k-8.1/src/force_env_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod input_section_types.mod molecule_types.mod particle_list_types.mod molecule_list_types.mod atomic_kind_list_types.mod cell_types.mod particle_types.mod distribution_1d_types.mod force_env_types.mod kinds.mod constraint_util.mod constraint.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'beta_gamma_psi.o' due to: /build/reproducible-path/cp2k-8.1/src/beta_gamma_psi.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'nnp_force.o' due to: /build/reproducible-path/cp2k-8.1/src/nnp_force.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod atomic_kind_types.mod particle_types.mod distribution_1d_types.mod input_section_types.mod nnp_environment_types.mod message_passing.mod cp_log_handling.mod periodic_table.mod kinds.mod base_hooks.mod physcon.mod cp_output_handling.mod nnp_acsf.mod nnp_model.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/nnp_force.F nnp_force.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:29 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"nnp_force.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' nnp_force.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'nnp_force.mod' due to: nnp_force.o /build/reproducible-path/cp2k-8.1/src/nnp_force.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod atomic_kind_types.mod particle_types.mod distribution_1d_types.mod input_section_types.mod nnp_environment_types.mod message_passing.mod cp_log_handling.mod periodic_table.mod kinds.mod base_hooks.mod physcon.mod cp_output_handling.mod nnp_acsf.mod nnp_model.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'beta_gamma_psi.o' due to: /build/reproducible-path/cp2k-8.1/src/beta_gamma_psi.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/beta_gamma_psi.F beta_gamma_psi.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"beta_gamma_psi.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' beta_gamma_psi.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"beta_gamma_psi.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' beta_gamma_psi.F90 /build/reproducible-path/cp2k-8.1/src/beta_gamma_psi.F:2275:2: 2275 | 20 f = a*rlog1(-lambda/a) + b*rlog1(lambda/b) @@ -47195,11 +47160,11 @@ 1353 | SUBROUTINE bratio(a, b, x, y, w, w1, ierr) | ^ Warning: 'bratio' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'beta_gamma_psi.mod' due to: beta_gamma_psi.o /build/reproducible-path/cp2k-8.1/src/beta_gamma_psi.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'beta_gamma_psi.mod' due to: beta_gamma_psi.o /build/reproducible-path/cp2k-8.1/src/beta_gamma_psi.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fp_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/fp_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fp_types.mod cp_subsys_types.mod particle_list_types.mod cell_types.mod particle_types.mod cp_log_handling.mod mathconstants.mod base_hooks.mod cp_output_handling.mod beta_gamma_psi.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fp_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/fp_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fp_types.mod cp_subsys_types.mod particle_list_types.mod particle_types.mod cell_types.mod cp_log_handling.mod beta_gamma_psi.mod kinds.mod mathconstants.mod cp_output_handling.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fp_methods.F fp_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fp_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fp_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fp_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fp_methods.F90 /build/reproducible-path/cp2k-8.1/src/fp_methods.F:197:72: 197 | tmpstr = cp_iter_string(logger%iter_info, fp_env%print_section) @@ -47210,26 +47175,11 @@ 183 | fp_env%bias_weight = EXP(fp_env%bias_energy/kT) | ^ Warning: 'kt' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fp_methods.mod' due to: fp_methods.o /build/reproducible-path/cp2k-8.1/src/fp_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fp_types.mod cp_subsys_types.mod particle_list_types.mod cell_types.mod particle_types.mod cp_log_handling.mod mathconstants.mod base_hooks.mod cp_output_handling.mod beta_gamma_psi.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'sirius_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/sirius_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pwdft_environment_types.mod qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod atom_types.mod particle_types.mod external_potential_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod mathconstants.mod kinds.mod atom_upf.mod cp_output_handling.mod atom_utils.mod qs_grid_atom.mod cp_log_handling.mod base_hooks.mod atom_kind_orbitals.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/sirius_interface.F sirius_interface.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"sirius_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' sirius_interface.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'sirius_interface.mod' due to: sirius_interface.o /build/reproducible-path/cp2k-8.1/src/sirius_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pwdft_environment_types.mod qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod atom_types.mod particle_types.mod external_potential_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod mathconstants.mod kinds.mod atom_upf.mod cp_output_handling.mod atom_utils.mod qs_grid_atom.mod cp_log_handling.mod base_hooks.mod atom_kind_orbitals.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fp_methods.mod' due to: fp_methods.o /build/reproducible-path/cp2k-8.1/src/fp_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 fp_types.mod cp_subsys_types.mod particle_list_types.mod particle_types.mod cell_types.mod cp_log_handling.mod beta_gamma_psi.mod kinds.mod mathconstants.mod cp_output_handling.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pwdft_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/pwdft_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pwdft_environment_types.mod qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod particle_types.mod molecule_kind_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod qs_energy_types.mod header.mod qs_subsys_methods.mod distribution_methods.mod kinds.mod sirius_interface.mod particle_methods.mod cp_symmetry.mod cp_log_handling.mod base_hooks.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pwdft_environment.F pwdft_environment.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pwdft_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pwdft_environment.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pwdft_environment.mod' due to: pwdft_environment.o /build/reproducible-path/cp2k-8.1/src/pwdft_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pwdft_environment_types.mod qs_subsys_types.mod cell_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod particle_types.mod molecule_kind_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod qs_energy_types.mod header.mod qs_subsys_methods.mod distribution_methods.mod kinds.mod sirius_interface.mod particle_methods.mod cp_symmetry.mod cp_log_handling.mod base_hooks.mod machine.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'grrm_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/grrm_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod force_env_types.mod cp_control_types.mod particle_types.mod qs_energy_types.mod base_hooks.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/grrm_utils.F grrm_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"grrm_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' grrm_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'grrm_utils.mod' due to: grrm_utils.o /build/reproducible-path/cp2k-8.1/src/grrm_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod force_env_types.mod cp_control_types.mod particle_types.mod qs_energy_types.mod base_hooks.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_env_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/force_env_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod pwdft_environment_types.mod qs_rho_types.mod mixed_energy_types.mod nnp_environment_types.mod pw_types.mod cp_iter_types.mod fist_environment_types.mod cell_types.mod qmmmx_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod embed_types.mod molecule_kind_types.mod pw_pool_types.mod eip_environment_types.mod metadynamics_types.mod cp_subsys_types.mod atprop_types.mod force_env_types.mod particle_list_types.mod cp_fm_types.mod global_types.mod cp_result_types.mod input_section_types.mod mixed_environment_types.mod qmmm_types.mod qs_energy_types.mod input_constants.mod string_utilities.mod pw_methods.mod force_fields_util.mod restraint.mod constraint_fxd.mod cp_result_methods.mod kinds.mod qmmm_util.mod kahan_sum.mod constraint_vsite.mod mixed_cdft_methods.mod nnp_force.mod qmmmx_force.mod eip_silicon.mod optimize_dmfet_potential.mod scine_utils.mod cp_output_handling.mod cp_fm_basic_linalg.mod mixed_environment_utils.mod physcon.mod virial_methods.mod external_potential_methods.mod message_passing.mod fparser.mod fist_force.mod bibliography.mod force_env_utils.mod cp_para_env.mod fp_methods.mod pwdft_environment.mod qmmm_force.mod mathlib.mod cp_log_handling.mod base_hooks.mod optimize_embedding_potential.mod qs_force.mod machine.mod grrm_utils.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_env_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/force_env_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod fist_environment_types.mod pw_pool_types.mod cp_result_types.mod eip_environment_types.mod cell_types.mod qs_rho_types.mod force_env_types.mod nnp_environment_types.mod atprop_types.mod particle_list_types.mod global_types.mod pwdft_environment_types.mod qmmmx_types.mod cp_fm_types.mod embed_types.mod molecule_kind_list_types.mod qs_environment_types.mod pw_env_types.mod qmmm_types.mod metadynamics_types.mod mixed_energy_types.mod mixed_environment_types.mod pw_types.mod input_section_types.mod molecule_kind_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod cp_iter_types.mod cp_log_handling.mod kinds.mod mixed_environment_utils.mod cp_output_handling.mod physcon.mod qmmm_util.mod bibliography.mod virial_methods.mod message_passing.mod qmmmx_force.mod kahan_sum.mod scine_utils.mod pwdft_environment.mod optimize_dmfet_potential.mod restraint.mod string_utilities.mod cp_para_env.mod constraint_fxd.mod eip_silicon.mod cp_fm_basic_linalg.mod mathlib.mod cp_result_methods.mod external_potential_methods.mod grrm_utils.mod mixed_cdft_methods.mod pw_methods.mod force_env_utils.mod optimize_embedding_potential.mod qmmm_force.mod constraint_vsite.mod qs_force.mod machine.mod fist_force.mod base_hooks.mod nnp_force.mod force_fields_util.mod fparser.mod input_constants.mod fp_methods.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/force_env_methods.F force_env_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:12:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_env_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_env_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:32 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_env_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_env_methods.F90 /build/reproducible-path/cp2k-8.1/src/force_env_methods.F:568:101: 568 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: ref_pos_atom, ref_pos_core, ref_pos_shell @@ -47266,130 +47216,215 @@ 1620 | REAL(KIND=dp) :: cluster_energy | ^ note: 'cluster_energy' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_env_methods.mod' due to: force_env_methods.o /build/reproducible-path/cp2k-8.1/src/force_env_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod pwdft_environment_types.mod qs_rho_types.mod mixed_energy_types.mod nnp_environment_types.mod pw_types.mod cp_iter_types.mod fist_environment_types.mod cell_types.mod qmmmx_types.mod cp_para_types.mod virial_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod embed_types.mod molecule_kind_types.mod pw_pool_types.mod eip_environment_types.mod metadynamics_types.mod cp_subsys_types.mod atprop_types.mod force_env_types.mod particle_list_types.mod cp_fm_types.mod global_types.mod cp_result_types.mod input_section_types.mod mixed_environment_types.mod qmmm_types.mod qs_energy_types.mod input_constants.mod string_utilities.mod pw_methods.mod force_fields_util.mod restraint.mod constraint_fxd.mod cp_result_methods.mod kinds.mod qmmm_util.mod kahan_sum.mod constraint_vsite.mod mixed_cdft_methods.mod nnp_force.mod qmmmx_force.mod eip_silicon.mod optimize_dmfet_potential.mod scine_utils.mod cp_output_handling.mod cp_fm_basic_linalg.mod mixed_environment_utils.mod physcon.mod virial_methods.mod external_potential_methods.mod message_passing.mod fparser.mod fist_force.mod bibliography.mod force_env_utils.mod cp_para_env.mod fp_methods.mod pwdft_environment.mod qmmm_force.mod mathlib.mod cp_log_handling.mod base_hooks.mod optimize_embedding_potential.mod qs_force.mod machine.mod grrm_utils.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_env_methods.mod' due to: force_env_methods.o /build/reproducible-path/cp2k-8.1/src/force_env_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod fist_environment_types.mod pw_pool_types.mod cp_result_types.mod eip_environment_types.mod cell_types.mod qs_rho_types.mod force_env_types.mod nnp_environment_types.mod atprop_types.mod particle_list_types.mod global_types.mod pwdft_environment_types.mod qmmmx_types.mod cp_fm_types.mod embed_types.mod molecule_kind_list_types.mod qs_environment_types.mod pw_env_types.mod qmmm_types.mod metadynamics_types.mod mixed_energy_types.mod mixed_environment_types.mod pw_types.mod input_section_types.mod molecule_kind_types.mod virial_types.mod cp_control_types.mod qs_energy_types.mod cp_iter_types.mod cp_log_handling.mod kinds.mod mixed_environment_utils.mod cp_output_handling.mod physcon.mod qmmm_util.mod bibliography.mod virial_methods.mod message_passing.mod qmmmx_force.mod kahan_sum.mod scine_utils.mod pwdft_environment.mod optimize_dmfet_potential.mod restraint.mod string_utilities.mod cp_para_env.mod constraint_fxd.mod eip_silicon.mod cp_fm_basic_linalg.mod mathlib.mod cp_result_methods.mod external_potential_methods.mod grrm_utils.mod mixed_cdft_methods.mod pw_methods.mod force_env_utils.mod optimize_embedding_potential.mod qmmm_force.mod constraint_vsite.mod qs_force.mod machine.mod fist_force.mod base_hooks.mod nnp_force.mod force_fields_util.mod fparser.mod input_constants.mod fp_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'embed_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/embed_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod cp_para_types.mod input_section_types.mod particle_types.mod cp_subsys_types.mod cell_types.mod embed_types.mod distribution_1d_types.mod cell_methods.mod base_hooks.mod cp_subsys_methods.mod distribution_methods.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/embed_environment.F embed_environment.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"embed_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' embed_environment.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'embed_environment.mod' due to: embed_environment.o /build/reproducible-path/cp2k-8.1/src/embed_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod cp_para_types.mod input_section_types.mod particle_types.mod cp_subsys_types.mod cell_types.mod embed_types.mod distribution_1d_types.mod cell_methods.mod base_hooks.mod cp_subsys_methods.mod distribution_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_free_energy.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_free_energy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_free_energy.F input_cp2k_free_energy.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_free_energy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_free_energy.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_free_energy.mod' due to: input_cp2k_free_energy.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_free_energy.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'embed_main.o' due to: /build/reproducible-path/cp2k-8.1/src/embed_main.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 embed_types.mod cp_para_types.mod input_section_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod cp_files.mod cp_para_env.mod embed_environment.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/embed_main.F embed_main.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"embed_main.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' embed_main.F90 -/build/reproducible-path/cp2k-8.1/src/embed_main.F:168:68: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'metadynamics_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/metadynamics_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod input_section_types.mod metadynamics_types.mod input_enumeration_types.mod force_env_types.mod input_keyword_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod machine.mod input_constants.mod physcon.mod cp_output_handling.mod input_cp2k_free_energy.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/metadynamics_utils.F metadynamics_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadynamics_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' metadynamics_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'metadynamics_utils.mod' due to: metadynamics_utils.o /build/reproducible-path/cp2k-8.1/src/metadynamics_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod input_section_types.mod metadynamics_types.mod input_enumeration_types.mod force_env_types.mod input_keyword_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod machine.mod input_constants.mod physcon.mod cp_output_handling.mod input_cp2k_free_energy.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_elpot.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_elpot.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod cell_types.mod qmmm_gaussian_types.mod input_section_types.mod mathconstants.mod cp_log_handling.mod kinds.mod input_constants.mod cp_output_handling.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_elpot.F qmmm_elpot.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_elpot.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_elpot.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_elpot.mod' due to: qmmm_elpot.o /build/reproducible-path/cp2k-8.1/src/qmmm_elpot.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types_low.mod cell_types.mod qmmm_gaussian_types.mod input_section_types.mod mathconstants.mod cp_log_handling.mod kinds.mod input_constants.mod cp_output_handling.mod memory_utilities.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_gaussian_data.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_data.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_data.F qmmm_gaussian_data.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gaussian_data.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gaussian_data.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_gaussian_data.mod' due to: qmmm_gaussian_data.o /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_data.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_gaussian_input.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod qmmm_gaussian_types.mod input_section_types.mod mathconstants.mod cp_log_handling.mod kinds.mod physcon.mod string_utilities.mod qmmm_gaussian_data.mod cp_parser_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_input.F qmmm_gaussian_input.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gaussian_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gaussian_input.F90 +/build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_input.F:1079:101: - 168 | embed_env%sub_logger(i)%p%iter_info%project_name = c_val - | 1 -Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'embed_main.mod' due to: embed_main.o /build/reproducible-path/cp2k-8.1/src/embed_main.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 embed_types.mod cp_para_types.mod input_section_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod cp_files.mod cp_para_env.mod embed_environment.mod kinds.mod + 1079 | qmmm_gaussian_fns(IRad)%pgf%Gk(istart + 1:) = qmmm_gaussian_fns(IRad)%pgf%Gk(istart + 1:)*rc + | ^ +Warning: 'rc' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_input.F:654:101: + + 654 | qmmm_gaussian_fns(IRad)%pgf%Gk(istart + 1:) = qmmm_gaussian_fns(IRad)%pgf%Gk(istart + 1:)*rc + | ^ +Warning: 'rc' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_gaussian_input.mod' due to: qmmm_gaussian_input.o /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_parser_types.mod qmmm_gaussian_types.mod input_section_types.mod mathconstants.mod cp_log_handling.mod kinds.mod physcon.mod string_utilities.mod qmmm_gaussian_data.mod cp_parser_methods.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'timings_report.mod' due to: timings_report.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_gaussian_init.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_env_types.mod pw_pool_types.mod qmmm_gaussian_types.mod input_section_types.mod gaussian_gridlevels.mod ao_util.mod cp_log_handling.mod kinds.mod qmmm_gaussian_input.mod input_constants.mod cp_output_handling.mod qmmm_gaussian_data.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_init.F qmmm_gaussian_init.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_gaussian_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_gaussian_init.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_gaussian_init.mod' due to: qmmm_gaussian_init.o /build/reproducible-path/cp2k-8.1/src/qmmm_gaussian_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod pw_env_types.mod pw_pool_types.mod qmmm_gaussian_types.mod input_section_types.mod gaussian_gridlevels.mod ao_util.mod cp_log_handling.mod kinds.mod qmmm_gaussian_input.mod input_constants.mod cp_output_handling.mod qmmm_gaussian_data.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_global.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_global.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod cp_fm_elpa.mod input_constants.mod string_utilities.mod timings.mod base_hooks.mod grid_api.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod bibliography.mod cp_blacs_env.mod machine.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_global.F input_cp2k_global.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_global.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_global.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_global.mod' due to: input_cp2k_global.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_global.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod cp_fm_elpa.mod input_constants.mod string_utilities.mod timings.mod base_hooks.mod grid_api.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod bibliography.mod cp_blacs_env.mod machine.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_per_elpot.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_per_elpot.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod cp_para_types.mod ewald_pw_types.mod qmmm_types_low.mod ewald_environment_types.mod cell_types.mod qmmm_gaussian_types.mod input_section_types.mod ewald_spline_util.mod mathconstants.mod cp_log_handling.mod ao_util.mod kinds.mod input_constants.mod cp_output_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_per_elpot.F qmmm_per_elpot.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_per_elpot.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_per_elpot.F90 +/build/reproducible-path/cp2k-8.1/src/qmmm_per_elpot.F:187:54: + + 187 | LG(idim) = fs*LG(idim)*1.0_dp/Vol + | ^ +Warning: 'fs' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_per_elpot.mod' due to: qmmm_per_elpot.o /build/reproducible-path/cp2k-8.1/src/qmmm_per_elpot.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_poisson_types.mod cp_para_types.mod ewald_pw_types.mod qmmm_types_low.mod ewald_environment_types.mod cell_types.mod qmmm_gaussian_types.mod input_section_types.mod ewald_spline_util.mod mathconstants.mod cp_log_handling.mod ao_util.mod kinds.mod input_constants.mod cp_output_handling.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_error_handling.mod' due to: cp_error_handling.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_init.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod external_potential_types.mod input_section_types.mod molecule_kind_types.mod pair_potential_types.mod shell_potential_types.mod cp_control_types.mod atomic_kind_list_types.mod force_field_types.mod cp_log_handling.mod kinds.mod qmmm_elpot.mod qmmm_gaussian_init.mod cp_output_handling.mod force_fields_input.mod cell_methods.mod qmmm_ff_fist.mod qmmm_per_elpot.mod cp_eri_mme_interface.mod base_hooks.mod input_constants.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_init.F qmmm_init.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_init.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_init.mod' due to: qmmm_init.o /build/reproducible-path/cp2k-8.1/src/qmmm_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod external_potential_types.mod input_section_types.mod molecule_kind_types.mod pair_potential_types.mod shell_potential_types.mod cp_control_types.mod atomic_kind_list_types.mod force_field_types.mod cp_log_handling.mod kinds.mod qmmm_elpot.mod qmmm_gaussian_init.mod cp_output_handling.mod force_fields_input.mod cell_methods.mod qmmm_ff_fist.mod qmmm_per_elpot.mod cp_eri_mme_interface.mod base_hooks.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'environment.o' due to: /build/reproducible-path/cp2k-8.1/src/environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod parallel_rng_types.mod input_enumeration_types.mod cp_para_types.mod force_env_types.mod cp_fm_types.mod global_types.mod input_section_types.mod input_constants.mod string_utilities.mod cp_fm_diag_utils.mod cp2k_info.mod cp_fm_diag.mod cp_fm_struct.mod header.mod cp_files.mod kinds.mod cp_output_handling.mod physcon.mod timings_report.mod message_passing.mod reference_manager.mod bibliography.mod voronoi_interface.mod gamma.mod cp_log_handling.mod timings.mod base_hooks.mod input_cp2k_global.mod orbital_transformation_matrices.mod machine.mod cp_error_handling.mod orbital_pointers.mod fft_tools.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/environment.F environment.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' environment.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'environment.mod' due to: environment.o /build/reproducible-path/cp2k-8.1/src/environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod parallel_rng_types.mod input_enumeration_types.mod cp_para_types.mod force_env_types.mod cp_fm_types.mod global_types.mod input_section_types.mod input_constants.mod string_utilities.mod cp_fm_diag_utils.mod cp2k_info.mod cp_fm_diag.mod cp_fm_struct.mod header.mod cp_files.mod kinds.mod cp_output_handling.mod physcon.mod timings_report.mod message_passing.mod reference_manager.mod bibliography.mod voronoi_interface.mod gamma.mod cp_log_handling.mod timings.mod base_hooks.mod input_cp2k_global.mod orbital_transformation_matrices.mod machine.mod cp_error_handling.mod orbital_pointers.mod fft_tools.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_pw_grid.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_pw_grid.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_env_types.mod pw_grid_types.mod qmmm_types_low.mod pw_pool_types.mod message_passing.mod kinds.mod pw_grids.mod input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_pw_grid.F qmmm_pw_grid.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_pw_grid.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_pw_grid.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_pw_grid.mod' due to: qmmm_pw_grid.o /build/reproducible-path/cp2k-8.1/src/qmmm_pw_grid.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_env_types.mod pw_grid_types.mod qmmm_types_low.mod pw_pool_types.mod message_passing.mod kinds.mod pw_grids.mod input_constants.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_qmmm.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_qmmm.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod cell_types.mod input_constants.mod input_cp2k_mm.mod string_utilities.mod base_hooks.mod cp_output_handling.mod input_cp2k_poisson.mod input_cp2k_subsys.mod pw_spline_utils.mod bibliography.mod kinds.mod cp_units.mod cp_spline_utils.mod cp_eri_mme_interface.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_qmmm.F input_cp2k_qmmm.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_qmmm.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_qmmm.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_qmmm.mod' due to: input_cp2k_qmmm.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_qmmm.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod cell_types.mod input_constants.mod input_cp2k_mm.mod string_utilities.mod base_hooks.mod cp_output_handling.mod input_cp2k_poisson.mod input_cp2k_subsys.mod pw_spline_utils.mod bibliography.mod kinds.mod cp_units.mod cp_spline_utils.mod cp_eri_mme_interface.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_fields_ext.o' due to: /build/reproducible-path/cp2k-8.1/src/force_fields_ext.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cp_parser_types.mod force_field_kind_types.mod force_field_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod memory_utilities.mod topology_amber.mod string_utilities.mod cp_parser_methods.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/force_fields_ext.F force_fields_ext.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:56 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields_ext.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields_ext.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_fields_ext.mod' due to: force_fields_ext.o /build/reproducible-path/cp2k-8.1/src/force_fields_ext.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cp_parser_types.mod force_field_kind_types.mod force_field_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_output_handling.mod memory_utilities.mod topology_amber.mod string_utilities.mod cp_parser_methods.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_pwdft.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_pwdft.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_pwdft.F input_cp2k_pwdft.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_pwdft.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_pwdft.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_pwdft.mod' due to: input_cp2k_pwdft.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_pwdft.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'force_fields.o' due to: /build/reproducible-path/cp2k-8.1/src/force_fields.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod force_field_kind_types.mod molecule_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod ewald_environment_types.mod input_section_types.mod molecule_kind_types.mod force_field_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod force_fields_input.mod force_fields_ext.mod base_hooks.mod force_fields_util.mod input_constants.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/force_fields.F force_fields.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"force_fields.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' force_fields.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'force_fields.mod' due to: force_fields.o /build/reproducible-path/cp2k-8.1/src/force_fields.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod force_field_kind_types.mod molecule_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod ewald_environment_types.mod input_section_types.mod molecule_kind_types.mod force_field_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod force_fields_input.mod force_fields_ext.mod base_hooks.mod force_fields_util.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_mixed.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_mixed.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_mixed.F input_cp2k_mixed.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_mixed.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_mixed.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_mixed.mod' due to: input_cp2k_mixed.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_mixed.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod fist_efield_types.mod cp_subsys_types.mod fist_environment_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod molecule_types.mod exclusion_types.mod particle_list_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod ewald_environment_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod ewald_pw_types.mod multipole_types.mod fist_energy_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_symmetry.mod bibliography.mod cell_methods.mod cp_subsys_methods.mod ewald_pw_methods.mod particle_methods.mod distribution_methods.mod force_fields.mod base_hooks.mod header.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_environment.F fist_environment.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:15:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_environment.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_environment.mod' due to: fist_environment.o /build/reproducible-path/cp2k-8.1/src/fist_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod fist_efield_types.mod cp_subsys_types.mod fist_environment_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod molecule_types.mod exclusion_types.mod particle_list_types.mod fist_nonbond_env_types.mod atomic_kind_types.mod ewald_environment_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod ewald_pw_types.mod multipole_types.mod fist_energy_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_symmetry.mod bibliography.mod cell_methods.mod cp_subsys_methods.mod ewald_pw_methods.mod particle_methods.mod distribution_methods.mod force_fields.mod base_hooks.mod header.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_eip.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_eip.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod cp_output_handling.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_eip.F input_cp2k_eip.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_eip.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_eip.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_eip.mod' due to: input_cp2k_eip.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_eip.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod cp_output_handling.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmm_create.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmm_create.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod fist_environment_types.mod qmmm_types_low.mod cell_types.mod global_types.mod fist_nonbond_env_types.mod qs_environment_types.mod qmmm_types.mod pw_env_types.mod input_section_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qmmm_init.mod bibliography.mod qmmm_pw_grid.mod cell_methods.mod cp_subsys_methods.mod qs_environment.mod base_hooks.mod fist_environment.mod header.mod input_constants.mod qmmm_links_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmm_create.F qmmm_create.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmm_create.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmm_create.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmm_create.mod' due to: qmmm_create.o /build/reproducible-path/cp2k-8.1/src/qmmm_create.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod fist_environment_types.mod qmmm_types_low.mod cell_types.mod global_types.mod fist_nonbond_env_types.mod qs_environment_types.mod qmmm_types.mod pw_env_types.mod input_section_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qmmm_init.mod bibliography.mod qmmm_pw_grid.mod cell_methods.mod cp_subsys_methods.mod qs_environment.mod base_hooks.mod fist_environment.mod header.mod input_constants.mod qmmm_links_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_resp.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_resp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_resp.F input_cp2k_resp.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_resp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_resp.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_resp.mod' due to: input_cp2k_resp.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_resp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_pwdft.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_pwdft.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod cp_output_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_pwdft.F input_cp2k_pwdft.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_pwdft.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_pwdft.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_pwdft.mod' due to: input_cp2k_pwdft.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_pwdft.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod cp_output_handling.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_atprop.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_atprop.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_atprop.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_atprop.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod bibliography.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_atprop.F input_cp2k_atprop.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:19 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_atprop.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_atprop.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_atprop.mod' due to: input_cp2k_atprop.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_atprop.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod bibliography.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_atprop.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_atprop.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_atprop.mod' due to: input_cp2k_atprop.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_atprop.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_keyword_types.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_resp.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_resp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_resp.F input_cp2k_resp.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_resp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_resp.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_resp.mod' due to: input_cp2k_resp.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_resp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_properties_dft.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_properties_dft.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_loc.mod input_constants.mod input_cp2k_xc.mod string_utilities.mod input_cp2k_resp.mod base_hooks.mod input_cp2k_atprop.mod bibliography.mod input_cp2k_dft.mod cp_output_handling.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_properties_dft.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_properties_dft.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_atprop.mod input_cp2k_xc.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod input_cp2k_loc.mod input_cp2k_dft.mod input_cp2k_resp.mod bibliography.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_properties_dft.F input_cp2k_properties_dft.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_properties_dft.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_properties_dft.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_properties_dft.mod' due to: input_cp2k_properties_dft.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_properties_dft.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_loc.mod input_constants.mod input_cp2k_xc.mod string_utilities.mod input_cp2k_resp.mod base_hooks.mod input_cp2k_atprop.mod bibliography.mod input_cp2k_dft.mod cp_output_handling.mod cp_units.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_properties_dft.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_properties_dft.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_properties_dft.mod' due to: input_cp2k_properties_dft.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_properties_dft.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_atprop.mod input_cp2k_xc.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod input_cp2k_loc.mod input_cp2k_dft.mod input_cp2k_resp.mod bibliography.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_qmmm.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_qmmm.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cell_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_poisson.mod cp_eri_mme_interface.mod kinds.mod base_hooks.mod cp_spline_utils.mod input_constants.mod cp_output_handling.mod input_cp2k_subsys.mod string_utilities.mod input_cp2k_mm.mod pw_spline_utils.mod bibliography.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_qmmm.F input_cp2k_qmmm.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_qmmm.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_qmmm.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_qmmm.mod' due to: input_cp2k_qmmm.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_qmmm.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cell_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_poisson.mod cp_eri_mme_interface.mod kinds.mod base_hooks.mod cp_spline_utils.mod input_constants.mod cp_output_handling.mod input_cp2k_subsys.mod string_utilities.mod input_cp2k_mm.mod pw_spline_utils.mod bibliography.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_mixed.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_mixed.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_mixed.F input_cp2k_mixed.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_mixed.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_mixed.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_mixed.mod' due to: input_cp2k_mixed.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_mixed.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_embed.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_embed.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_embed.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_embed.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_embed.F input_cp2k_embed.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_embed.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_embed.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_embed.mod' due to: input_cp2k_embed.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_embed.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_embed.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_embed.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_embed.mod' due to: input_cp2k_embed.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_embed.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_nnp.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_nnp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_eip.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_eip.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_constants.mod cp_output_handling.mod string_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_eip.F input_cp2k_eip.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_eip.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_eip.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_eip.mod' due to: input_cp2k_eip.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_eip.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_constants.mod cp_output_handling.mod string_utilities.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_nnp.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_nnp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod cp_output_handling.mod bibliography.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_nnp.F input_cp2k_nnp.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_nnp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_nnp.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_nnp.mod' due to: input_cp2k_nnp.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_nnp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod base_hooks.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_nnp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_nnp.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_nnp.mod' due to: input_cp2k_nnp.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_nnp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod cp_output_handling.mod bibliography.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_force_eval.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_force_eval.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod input_cp2k_subsys.mod input_cp2k_qmmm.mod kinds.mod input_cp2k_pwdft.mod input_cp2k_mm.mod input_cp2k_mixed.mod input_cp2k_eip.mod cp_output_handling.mod input_cp2k_properties_dft.mod input_cp2k_embed.mod base_hooks.mod input_cp2k_nnp.mod input_cp2k_dft.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_force_eval.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_force_eval.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod kinds.mod cp_output_handling.mod input_cp2k_pwdft.mod cp_units.mod string_utilities.mod input_cp2k_dft.mod input_cp2k_properties_dft.mod input_cp2k_subsys.mod input_cp2k_qmmm.mod input_cp2k_mixed.mod input_cp2k_embed.mod base_hooks.mod input_cp2k_mm.mod input_constants.mod input_cp2k_eip.mod input_cp2k_nnp.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_force_eval.F input_cp2k_force_eval.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_force_eval.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_force_eval.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_force_eval.mod' due to: input_cp2k_force_eval.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_force_eval.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod input_cp2k_subsys.mod input_cp2k_qmmm.mod kinds.mod input_cp2k_pwdft.mod input_cp2k_mm.mod input_cp2k_mixed.mod input_cp2k_eip.mod cp_output_handling.mod input_cp2k_properties_dft.mod input_cp2k_embed.mod base_hooks.mod input_cp2k_nnp.mod input_cp2k_dft.mod cp_units.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_force_eval.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_force_eval.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_force_eval.mod' due to: input_cp2k_force_eval.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_force_eval.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod kinds.mod cp_output_handling.mod input_cp2k_pwdft.mod cp_units.mod string_utilities.mod input_cp2k_dft.mod input_cp2k_properties_dft.mod input_cp2k_subsys.mod input_cp2k_qmmm.mod input_cp2k_mixed.mod input_cp2k_embed.mod base_hooks.mod input_cp2k_mm.mod input_constants.mod input_cp2k_eip.mod input_cp2k_nnp.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'eip_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/eip_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod cp_para_types.mod input_section_types.mod particle_types.mod eip_environment_types.mod cp_subsys_types.mod cell_types.mod distribution_1d_types.mod cell_methods.mod base_hooks.mod cp_subsys_methods.mod distribution_methods.mod kinds.mod particle_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/eip_environment.F eip_environment.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"eip_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' eip_environment.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'eip_environment.mod' due to: eip_environment.o /build/reproducible-path/cp2k-8.1/src/eip_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod cp_para_types.mod input_section_types.mod particle_types.mod eip_environment_types.mod cp_subsys_types.mod cell_types.mod distribution_1d_types.mod cell_methods.mod base_hooks.mod cp_subsys_methods.mod distribution_methods.mod kinds.mod particle_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmmx_create.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmmx_create.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types.mod cp_subsys_types.mod global_types.mod qmmmx_types.mod input_section_types.mod qmmmx_util.mod qmmm_create.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmmx_create.F qmmmx_create.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_create.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_create.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmmx_create.mod' due to: qmmmx_create.o /build/reproducible-path/cp2k-8.1/src/qmmmx_create.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qmmm_types.mod cp_subsys_types.mod global_types.mod qmmmx_types.mod input_section_types.mod qmmmx_util.mod qmmm_create.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod molecule_types.mod mixed_energy_types.mod mixed_environment_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod cell_methods.mod cp_subsys_methods.mod distribution_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_environment.F mixed_environment.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_environment.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_environment.mod' due to: mixed_environment.o /build/reproducible-path/cp2k-8.1/src/mixed_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod molecule_types.mod mixed_energy_types.mod mixed_environment_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod cell_methods.mod cp_subsys_methods.mod distribution_methods.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mixed_main.o' due to: /build/reproducible-path/cp2k-8.1/src/mixed_main.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mixed_environment_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod cp_output_handling.mod cp_para_env.mod mixed_environment.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mixed_main.F mixed_main.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mixed_main.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mixed_main.F90 +/build/reproducible-path/cp2k-8.1/src/mixed_main.F:167:68: + + 167 | mixed_env%sub_logger(i)%p%iter_info%project_name = c_val + | 1 +Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mixed_main.mod' due to: mixed_main.o /build/reproducible-path/cp2k-8.1/src/mixed_main.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mixed_environment_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod cp_output_handling.mod cp_para_env.mod mixed_environment.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'embed_environment.o' due to: /build/reproducible-path/cp2k-8.1/src/embed_environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod embed_types.mod cp_subsys_types.mod molecule_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod cell_methods.mod cp_subsys_methods.mod distribution_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/embed_environment.F embed_environment.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"embed_environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' embed_environment.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'embed_environment.mod' due to: embed_environment.o /build/reproducible-path/cp2k-8.1/src/embed_environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod embed_types.mod cp_subsys_types.mod molecule_types.mod particle_types.mod cell_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod cell_methods.mod cp_subsys_methods.mod distribution_methods.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'embed_main.o' due to: /build/reproducible-path/cp2k-8.1/src/embed_main.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod embed_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod cp_output_handling.mod cp_para_env.mod embed_environment.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/embed_main.F embed_main.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"embed_main.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' embed_main.F90 +/build/reproducible-path/cp2k-8.1/src/embed_main.F:168:68: + + 168 | embed_env%sub_logger(i)%p%iter_info%project_name = c_val + | 1 +Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'embed_main.mod' due to: embed_main.o /build/reproducible-path/cp2k-8.1/src/embed_main.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod embed_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod cp_output_handling.mod cp_para_env.mod embed_environment.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_main.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_main.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod input_section_types.mod qmmm_types_low.mod cp_subsys_types.mod fist_environment_types.mod force_env_types.mod force_env_methods.mod base_hooks.mod fist_environment.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'fist_main.o' due to: /build/reproducible-path/cp2k-8.1/src/fist_main.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod input_section_types.mod fist_environment_types.mod qmmm_types_low.mod global_types.mod force_env_types.mod fist_environment.mod force_env_methods.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/fist_main.F fist_main.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_main.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_main.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_main.mod' due to: fist_main.o /build/reproducible-path/cp2k-8.1/src/fist_main.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod input_section_types.mod qmmm_types_low.mod cp_subsys_types.mod fist_environment_types.mod force_env_types.mod force_env_methods.mod base_hooks.mod fist_environment.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"fist_main.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' fist_main.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'fist_main.mod' due to: fist_main.o /build/reproducible-path/cp2k-8.1/src/fist_main.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod input_section_types.mod fist_environment_types.mod qmmm_types_low.mod global_types.mod force_env_types.mod fist_environment.mod force_env_methods.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_free_energy.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_free_energy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_free_energy.F input_cp2k_free_energy.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_free_energy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_free_energy.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_free_energy.mod' due to: input_cp2k_free_energy.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_free_energy.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_error_handling.mod' due to: cp_error_handling.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'metadynamics_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/metadynamics_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cp_para_types.mod input_section_types.mod metadynamics_types.mod cp_subsys_types.mod force_env_types.mod input_enumeration_types.mod input_constants.mod input_cp2k_free_energy.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod cp_files.mod machine.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/metadynamics_utils.F metadynamics_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:32 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadynamics_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' metadynamics_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'metadynamics_utils.mod' due to: metadynamics_utils.o /build/reproducible-path/cp2k-8.1/src/metadynamics_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cp_para_types.mod input_section_types.mod metadynamics_types.mod cp_subsys_types.mod force_env_types.mod input_enumeration_types.mod input_constants.mod input_cp2k_free_energy.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod cp_files.mod machine.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_global.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_global.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod timings.mod base_hooks.mod machine.mod input_constants.mod cp_fm_elpa.mod cp_blacs_env.mod cp_dbcsr_cp2k_link.mod cp_output_handling.mod string_utilities.mod bibliography.mod grid_api.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_global.F input_cp2k_global.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_global.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_global.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_global.mod' due to: input_cp2k_global.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_global.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod timings.mod base_hooks.mod machine.mod input_constants.mod cp_fm_elpa.mod cp_blacs_env.mod cp_dbcsr_cp2k_link.mod cp_output_handling.mod string_utilities.mod bibliography.mod grid_api.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'timings_report.mod' due to: timings_report.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'f77_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/f77_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod pwdft_environment_types.mod nnp_environment_types.mod cell_types.mod input_enumeration_types.mod qmmmx_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod embed_types.mod eip_environment_types.mod metadynamics_types.mod cp_subsys_types.mod force_env_types.mod global_types.mod fp_types.mod cp_result_types.mod input_section_types.mod mixed_environment_types.mod qmmm_types.mod timings_types.mod qs_environment.mod input_constants.mod input_cp2k_read.mod qmmmx_create.mod cp2k_info.mod cp_files.mod input_cp2k_check.mod cp_result_methods.mod kinds.mod nnp_environment.mod mixed_main.mod force_env_methods.mod grid_api.mod string_table.mod cp_output_handling.mod embed_main.mod message_passing.mod environment.mod reference_manager.mod bibliography.mod pwdft_environment.mod cp_para_env.mod qmmm_create.mod input_cp2k_force_eval.mod eip_environment.mod fist_main.mod base_hooks.mod cp_log_handling.mod metadynamics_utils.mod periodic_table.mod timings.mod pw_cuda.mod machine.mod cp_error_handling.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'environment.o' due to: /build/reproducible-path/cp2k-8.1/src/environment.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_enumeration_types.mod force_env_types.mod parallel_rng_types.mod global_types.mod cp_fm_types.mod input_keyword_types.mod input_section_types.mod cp_log_handling.mod kinds.mod orbital_transformation_matrices.mod physcon.mod cp_output_handling.mod fft_tools.mod cp_fm_struct.mod gamma.mod bibliography.mod reference_manager.mod message_passing.mod timings.mod string_utilities.mod cp2k_info.mod voronoi_interface.mod cp_files.mod orbital_pointers.mod cp_fm_diag_utils.mod input_cp2k_global.mod timings_report.mod machine.mod base_hooks.mod header.mod cp_fm_diag.mod input_constants.mod cp_error_handling.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/environment.F environment.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"environment.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' environment.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'environment.mod' due to: environment.o /build/reproducible-path/cp2k-8.1/src/environment.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_enumeration_types.mod force_env_types.mod parallel_rng_types.mod global_types.mod cp_fm_types.mod input_keyword_types.mod input_section_types.mod cp_log_handling.mod kinds.mod orbital_transformation_matrices.mod physcon.mod cp_output_handling.mod fft_tools.mod cp_fm_struct.mod gamma.mod bibliography.mod reference_manager.mod message_passing.mod timings.mod string_utilities.mod cp2k_info.mod voronoi_interface.mod cp_files.mod orbital_pointers.mod cp_fm_diag_utils.mod input_cp2k_global.mod timings_report.mod machine.mod base_hooks.mod header.mod cp_fm_diag.mod input_constants.mod cp_error_handling.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'f77_interface.o' due to: /build/reproducible-path/cp2k-8.1/src/f77_interface.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod timings_types.mod cp_result_types.mod eip_environment_types.mod cell_types.mod input_enumeration_types.mod force_env_types.mod nnp_environment_types.mod fp_types.mod pwdft_environment_types.mod global_types.mod qmmmx_types.mod embed_types.mod input_keyword_types.mod qs_environment_types.mod qmmm_types.mod metadynamics_types.mod mixed_environment_types.mod input_section_types.mod virial_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod periodic_table.mod eip_environment.mod bibliography.mod message_passing.mod reference_manager.mod timings.mod input_cp2k_read.mod pwdft_environment.mod nnp_environment.mod force_env_methods.mod cp_para_env.mod cp2k_info.mod metadynamics_utils.mod cp_result_methods.mod qs_environment.mod cp_files.mod qmmm_create.mod input_cp2k_force_eval.mod string_table.mod machine.mod pw_cuda.mod base_hooks.mod qmmmx_create.mod mixed_main.mod embed_main.mod input_cp2k_check.mod input_constants.mod fist_main.mod cp_error_handling.mod environment.mod grid_api.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/f77_interface.F f77_interface.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"f77_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' f77_interface.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"f77_interface.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' f77_interface.F90 /build/reproducible-path/cp2k-8.1/src/f77_interface.F:1170:21: 1170 | SUBROUTINE get_vel(env_id, vel, n_el, ierr) | ^ Warning: 'get_vel' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'f77_interface.mod' due to: f77_interface.o /build/reproducible-path/cp2k-8.1/src/f77_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod pwdft_environment_types.mod nnp_environment_types.mod cell_types.mod input_enumeration_types.mod qmmmx_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod embed_types.mod eip_environment_types.mod metadynamics_types.mod cp_subsys_types.mod force_env_types.mod global_types.mod fp_types.mod cp_result_types.mod input_section_types.mod mixed_environment_types.mod qmmm_types.mod timings_types.mod qs_environment.mod input_constants.mod input_cp2k_read.mod qmmmx_create.mod cp2k_info.mod cp_files.mod input_cp2k_check.mod cp_result_methods.mod kinds.mod nnp_environment.mod mixed_main.mod force_env_methods.mod grid_api.mod string_table.mod cp_output_handling.mod embed_main.mod message_passing.mod environment.mod reference_manager.mod bibliography.mod pwdft_environment.mod cp_para_env.mod qmmm_create.mod input_cp2k_force_eval.mod eip_environment.mod fist_main.mod base_hooks.mod cp_log_handling.mod metadynamics_utils.mod periodic_table.mod timings.mod pw_cuda.mod machine.mod cp_error_handling.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'f77_interface.mod' due to: f77_interface.o /build/reproducible-path/cp2k-8.1/src/f77_interface.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod timings_types.mod cp_result_types.mod eip_environment_types.mod cell_types.mod input_enumeration_types.mod force_env_types.mod nnp_environment_types.mod fp_types.mod pwdft_environment_types.mod global_types.mod qmmmx_types.mod embed_types.mod input_keyword_types.mod qs_environment_types.mod qmmm_types.mod metadynamics_types.mod mixed_environment_types.mod input_section_types.mod virial_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod periodic_table.mod eip_environment.mod bibliography.mod message_passing.mod reference_manager.mod timings.mod input_cp2k_read.mod pwdft_environment.mod nnp_environment.mod force_env_methods.mod cp_para_env.mod cp2k_info.mod metadynamics_utils.mod cp_result_methods.mod qs_environment.mod cp_files.mod qmmm_create.mod input_cp2k_force_eval.mod string_table.mod machine.mod pw_cuda.mod base_hooks.mod qmmmx_create.mod mixed_main.mod embed_main.mod input_cp2k_check.mod input_constants.mod fist_main.mod cp_error_handling.mod environment.mod grid_api.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'replica_types.o' due to: /build/reproducible-path/cp2k-8.1/src/replica_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_result_types.mod qs_wf_history_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod f77_interface.mod cp_output_handling.mod cp_para_env.mod cp_result_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'replica_types.o' due to: /build/reproducible-path/cp2k-8.1/src/replica_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_wf_history_types.mod cp_result_types.mod message_passing.mod cp_result_methods.mod cp_log_handling.mod kinds.mod f77_interface.mod cp_output_handling.mod cp_para_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/replica_types.F replica_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"replica_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' replica_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'replica_types.mod' due to: replica_types.o /build/reproducible-path/cp2k-8.1/src/replica_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_result_types.mod qs_wf_history_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod f77_interface.mod cp_output_handling.mod cp_para_env.mod cp_result_methods.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"replica_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' replica_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'replica_types.mod' due to: replica_types.o /build/reproducible-path/cp2k-8.1/src/replica_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_wf_history_types.mod cp_result_types.mod message_passing.mod cp_result_methods.mod cp_log_handling.mod kinds.mod f77_interface.mod cp_output_handling.mod cp_para_env.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'replica_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/replica_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_result_types.mod input_section_types.mod cp_subsys_types.mod replica_types.mod qs_environment_types.mod force_env_types.mod cp_control_types.mod qs_wf_history_types.mod cp_log_handling.mod message_passing.mod cp_files.mod base_hooks.mod cp_output_handling.mod f77_interface.mod qs_wf_history_methods.mod cp_para_env.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'replica_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/replica_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_subsys_types.mod input_section_types.mod qs_wf_history_types.mod cp_control_types.mod cp_result_types.mod force_env_types.mod replica_types.mod message_passing.mod cp_log_handling.mod cp_files.mod f77_interface.mod kinds.mod cp_output_handling.mod qs_wf_history_methods.mod cp_para_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/replica_methods.F replica_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"replica_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' replica_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'replica_methods.mod' due to: replica_methods.o /build/reproducible-path/cp2k-8.1/src/replica_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_result_types.mod input_section_types.mod cp_subsys_types.mod replica_types.mod qs_environment_types.mod force_env_types.mod cp_control_types.mod qs_wf_history_types.mod cp_log_handling.mod message_passing.mod cp_files.mod base_hooks.mod cp_output_handling.mod f77_interface.mod qs_wf_history_methods.mod cp_para_env.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"replica_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' replica_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'replica_methods.mod' due to: replica_methods.o /build/reproducible-path/cp2k-8.1/src/replica_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_subsys_types.mod input_section_types.mod qs_wf_history_types.mod cp_control_types.mod cp_result_types.mod force_env_types.mod replica_types.mod message_passing.mod cp_log_handling.mod cp_files.mod f77_interface.mod kinds.mod cp_output_handling.mod qs_wf_history_methods.mod cp_para_env.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mode_selective.o' due to: /build/reproducible-path/cp2k-8.1/src/mode_selective.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod input_section_types.mod replica_types.mod particle_types.mod input_constants.mod mathlib.mod cp_log_handling.mod message_passing.mod replica_methods.mod base_hooks.mod util.mod cp_output_handling.mod molden_utils.mod cp_files.mod physcon.mod cp_result_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mode_selective.o' due to: /build/reproducible-path/cp2k-8.1/src/mode_selective.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod replica_types.mod global_types.mod particle_types.mod input_section_types.mod mathlib.mod cp_result_methods.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod util.mod input_constants.mod cp_output_handling.mod physcon.mod replica_methods.mod molden_utils.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mode_selective.F mode_selective.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:13:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mode_selective.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mode_selective.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mode_selective.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mode_selective.F90 /build/reproducible-path/cp2k-8.1/src/mode_selective.F:843:100: 843 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :) :: approx_H, H_save, residuum, tmp_b, tmp_s @@ -47414,11 +47449,11 @@ /build/reproducible-path/cp2k-8.1/src/mode_selective.F:120:67: Warning: 'tmp_dip.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/mode_selective.F:120:67: Warning: 'tmp_dip.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/mode_selective.F:120:67: Warning: 'tmp_dip.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mode_selective.mod' due to: mode_selective.o /build/reproducible-path/cp2k-8.1/src/mode_selective.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod input_section_types.mod replica_types.mod particle_types.mod input_constants.mod mathlib.mod cp_log_handling.mod message_passing.mod replica_methods.mod base_hooks.mod util.mod cp_output_handling.mod molden_utils.mod cp_files.mod physcon.mod cp_result_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mode_selective.mod' due to: mode_selective.o /build/reproducible-path/cp2k-8.1/src/mode_selective.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod replica_types.mod global_types.mod particle_types.mod input_section_types.mod mathlib.mod cp_result_methods.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod util.mod input_constants.mod cp_output_handling.mod physcon.mod replica_methods.mod molden_utils.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'vibrational_analysis.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/vibrational_analysis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod cp_para_types.mod replica_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod cp_fm_types.mod global_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod mathconstants.mod cp_fm_struct.mod header.mod cp_blacs_env.mod util.mod cp_result_methods.mod kinds.mod motion_utils.mod f77_interface.mod scine_utils.mod molden_utils.mod mode_selective.mod cp_output_handling.mod physcon.mod particle_methods.mod mathlib.mod cp_log_handling.mod replica_methods.mod base_hooks.mod grrm_utils.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'vibrational_analysis.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/vibrational_analysis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod force_env_types.mod particle_list_types.mod global_types.mod cp_fm_types.mod molecule_kind_list_types.mod atomic_kind_types.mod input_section_types.mod molecule_kind_types.mod replica_types.mod mode_selective.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod cp_output_handling.mod cp_fm_struct.mod scine_utils.mod replica_methods.mod motion_utils.mod mathlib.mod cp_result_methods.mod grrm_utils.mod util.mod particle_methods.mod cp_blacs_env.mod molden_utils.mod base_hooks.mod mathconstants.mod header.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/vibrational_analysis.F vibrational_analysis.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/vibrational_analysis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' vibrational_analysis.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/vibrational_analysis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' vibrational_analysis.F90 /build/reproducible-path/cp2k-8.1/src/motion/vibrational_analysis.F:124:72: 124 | REAL(KIND=dp), DIMENSION(:, :), POINTER :: D, dip_deriv, RotTrM @@ -47434,119 +47469,139 @@ /build/reproducible-path/cp2k-8.1/src/motion/vibrational_analysis.F:125:67: Warning: 'tmp_dip.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/motion/vibrational_analysis.F:125:67: Warning: 'tmp_dip.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/motion/vibrational_analysis.F:125:67: Warning: 'tmp_dip.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'metadynamics.o' due to: /build/reproducible-path/cp2k-8.1/src/metadynamics.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod metadynamics_types.mod cp_subsys_types.mod simpar_types.mod force_env_types.mod particle_list_types.mod input_section_types.mod colvar_types.mod input_constants.mod constraint_fxd.mod kinds.mod cp_output_handling.mod physcon.mod message_passing.mod reference_manager.mod bibliography.mod metadynamics_utils.mod cp_log_handling.mod base_hooks.mod colvar_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/metadynamics.F metadynamics.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadynamics.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' metadynamics.F90 -/build/reproducible-path/cp2k-8.1/src/metadynamics.F:603:22: - - 603 | IF (scal*check_val > 0.0_dp) CYCLE - | ^ -Warning: 'check_val' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'metadynamics.mod' due to: metadynamics.o /build/reproducible-path/cp2k-8.1/src/metadynamics.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod metadynamics_types.mod cp_subsys_types.mod simpar_types.mod force_env_types.mod particle_list_types.mod input_section_types.mod colvar_types.mod input_constants.mod constraint_fxd.mod kinds.mod cp_output_handling.mod physcon.mod message_passing.mod reference_manager.mod bibliography.mod metadynamics_utils.mod cp_log_handling.mod base_hooks.mod colvar_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'extended_system_dynamics.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_dynamics.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod molecule_types.mod shell_potential_types.mod particle_types.mod distribution_1d_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod thermostat_utils.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_dynamics.F extended_system_dynamics.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/extended_system_dynamics.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' extended_system_dynamics.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'extended_system_dynamics.mod' due to: extended_system_dynamics.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_dynamics.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod molecule_types.mod shell_potential_types.mod particle_types.mod distribution_1d_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod thermostat_utils.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'integrator_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/integrator_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod barostat_types.mod thermostat_types.mod atomic_kind_types.mod extended_system_types.mod md_environment_types.mod distribution_1d_types.mod molecule_kind_types.mod virial_types.mod shell_potential_types.mod simpar_types.mod kinds.mod message_passing.mod mathlib.mod constraint_util.mod constraint.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/integrator_utils.F integrator_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/integrator_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' integrator_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'integrator_utils.mod' due to: integrator_utils.o /build/reproducible-path/cp2k-8.1/src/motion/integrator_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cell_types.mod molecule_types.mod barostat_types.mod thermostat_types.mod atomic_kind_types.mod extended_system_types.mod md_environment_types.mod distribution_1d_types.mod molecule_kind_types.mod virial_types.mod shell_potential_types.mod simpar_types.mod kinds.mod message_passing.mod mathlib.mod constraint_util.mod constraint.mod base_hooks.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ls_matrix_exp.o' due to: /build/reproducible-path/cp2k-8.1/src/ls_matrix_exp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_log_handling.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ls_matrix_exp.F ls_matrix_exp.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ls_matrix_exp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ls_matrix_exp.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ls_matrix_exp.mod' due to: ls_matrix_exp.o /build/reproducible-path/cp2k-8.1/src/ls_matrix_exp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_log_handling.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_make_propagators.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_make_propagators.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod rt_propagation_types.mod cp_fm_types.mod matrix_exp.mod kinds.mod cp_fm_vect.mod base_hooks.mod ls_matrix_exp.mod cp_dbcsr_operations.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/emd/rt_make_propagators.F rt_make_propagators.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_make_propagators.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_make_propagators.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_make_propagators.mod' due to: rt_make_propagators.o /build/reproducible-path/cp2k-8.1/src/emd/rt_make_propagators.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_control_types.mod rt_propagation_types.mod cp_fm_types.mod matrix_exp.mod kinds.mod cp_fm_vect.mod base_hooks.mod ls_matrix_exp.mod cp_dbcsr_operations.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagation_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod input_constants.mod mathconstants.mod qs_dftb_matrices.mod qs_rho_methods.mod kinds.mod qs_mo_io.mod cp_fm_vect.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_overlap.mod cp_log_handling.mod base_hooks.mod qs_mo_methods.mod orbital_pointers.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagation_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod rt_propagation_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_fm_vect.mod qs_dftb_matrices.mod qs_rho_methods.mod cp_dbcsr_operations.mod qs_mo_methods.mod cp_fm_basic_linalg.mod orbital_pointers.mod base_hooks.mod mathconstants.mod qs_mo_io.mod qs_overlap.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_utils.F rt_propagation_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_propagation_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagation_utils.mod' due to: rt_propagation_utils.o /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod qs_mo_types.mod qs_kind_types.mod cp_para_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod qs_ks_types.mod input_constants.mod mathconstants.mod qs_dftb_matrices.mod qs_rho_methods.mod kinds.mod qs_mo_io.mod cp_fm_vect.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod qs_overlap.mod cp_log_handling.mod base_hooks.mod qs_mo_methods.mod orbital_pointers.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_propagation_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagation_utils.mod' due to: rt_propagation_utils.o /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod rt_propagation_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_fm_vect.mod qs_dftb_matrices.mod qs_rho_methods.mod cp_dbcsr_operations.mod qs_mo_methods.mod cp_fm_basic_linalg.mod orbital_pointers.mod base_hooks.mod mathconstants.mod qs_mo_io.mod qs_overlap.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagation_output.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_output.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_kind_types.mod rt_propagation_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod pw_methods.mod cp_gemm_interface.mod qs_scf_post_gpw.mod cp_fm_struct.mod kinds.mod kahan_sum.mod qs_mo_io.mod qs_linres_current.mod qs_scf_post_tb.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod rt_propagation_utils.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagation_output.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_output.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod qs_rho_types.mod particle_list_types.mod rt_propagation_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod kahan_sum.mod cp_realspace_grid_cube.mod qs_linres_current.mod cp_fm_basic_linalg.mod qs_scf_post_tb.mod pw_methods.mod rt_propagation_utils.mod machine.mod base_hooks.mod qs_mo_io.mod input_constants.mod qs_scf_post_gpw.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_output.F rt_propagation_output.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_propagation_output.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_output.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_propagation_output.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_output.F90 /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_output.F:726:18: 726 | stride = section_get_ivals(dft_section, "REAL_TIME_PROPAGATION%PRINT%CURRENT%STRIDE") | 1 Warning: POINTER-valued function appears on right-hand side of assignment at (1) [-Wsurprising] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagation_output.mod' due to: rt_propagation_output.o /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_output.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod pw_types.mod qs_subsys_types.mod qs_kind_types.mod rt_propagation_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod qs_linres_types.mod pw_pool_types.mod particle_list_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod pw_methods.mod cp_gemm_interface.mod qs_scf_post_gpw.mod cp_fm_struct.mod kinds.mod kahan_sum.mod qs_mo_io.mod qs_linres_current.mod qs_scf_post_tb.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod message_passing.mod rt_propagation_utils.mod cp_log_handling.mod base_hooks.mod cp_realspace_grid_cube.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagation_output.mod' due to: rt_propagation_output.o /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_output.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pw_pool_types.mod particle_types.mod qs_rho_types.mod particle_list_types.mod rt_propagation_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod qs_kind_types.mod qs_linres_types.mod input_section_types.mod qs_subsys_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod cp_dbcsr_operations.mod message_passing.mod kahan_sum.mod cp_realspace_grid_cube.mod qs_linres_current.mod cp_fm_basic_linalg.mod qs_scf_post_tb.mod pw_methods.mod rt_propagation_utils.mod machine.mod base_hooks.mod qs_mo_io.mod input_constants.mod qs_scf_post_gpw.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ls_matrix_exp.o' due to: /build/reproducible-path/cp2k-8.1/src/ls_matrix_exp.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_log_handling.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ls_matrix_exp.F ls_matrix_exp.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ls_matrix_exp.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ls_matrix_exp.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ls_matrix_exp.mod' due to: ls_matrix_exp.o /build/reproducible-path/cp2k-8.1/src/ls_matrix_exp.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod cp_log_handling.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagation_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod cp_cfm_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod cp_fm_vect.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod cp_cfm_basic_linalg.mod ls_matrix_exp.mod qs_ks_methods.mod cp_fm_basic_linalg.mod mathlib.mod cp_dbcsr_cholesky.mod iterate_matrix.mod rt_make_propagators.mod rt_propagation_utils.mod base_hooks.mod rt_propagation_output.mod qs_energy_init.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_methods.F rt_propagation_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:16:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_propagation_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagation_methods.mod' due to: rt_propagation_methods.o /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod cp_cfm_types.mod cp_control_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod cp_fm_vect.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod cp_cfm_basic_linalg.mod ls_matrix_exp.mod qs_ks_methods.mod cp_fm_basic_linalg.mod mathlib.mod cp_dbcsr_cholesky.mod iterate_matrix.mod rt_make_propagators.mod rt_propagation_utils.mod base_hooks.mod rt_propagation_output.mod qs_energy_init.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_make_propagators.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_make_propagators.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rt_propagation_types.mod cp_control_types.mod cp_fm_types.mod cp_fm_vect.mod input_constants.mod base_hooks.mod matrix_exp.mod cp_dbcsr_operations.mod ls_matrix_exp.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/emd/rt_make_propagators.F rt_make_propagators.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_make_propagators.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_make_propagators.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_make_propagators.mod' due to: rt_make_propagators.o /build/reproducible-path/cp2k-8.1/src/emd/rt_make_propagators.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rt_propagation_types.mod cp_control_types.mod cp_fm_types.mod cp_fm_vect.mod input_constants.mod base_hooks.mod matrix_exp.mod cp_dbcsr_operations.mod ls_matrix_exp.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_restart_rng.o' due to: /build/reproducible-path/cp2k-8.1/src/input_restart_rng.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod input_val_types.mod input_section_types.mod cp_linked_list_input.mod string_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_restart_rng.F input_restart_rng.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_restart_rng.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_restart_rng.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_restart_rng.mod' due to: input_restart_rng.o /build/reproducible-path/cp2k-8.1/src/input_restart_rng.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod input_val_types.mod input_section_types.mod cp_linked_list_input.mod string_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagation_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_types.mod cp_cfm_types.mod qs_energy_types.mod input_constants.mod qs_ks_methods.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod kinds.mod cp_fm_vect.mod rt_propagation_output.mod qs_energy_init.mod cp_dbcsr_operations.mod ls_matrix_exp.mod cp_fm_basic_linalg.mod iterate_matrix.mod rt_propagation_utils.mod cp_dbcsr_cholesky.mod rt_make_propagators.mod bibliography.mod mathlib.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_methods.F rt_propagation_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_propagation_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagation_methods.mod' due to: rt_propagation_methods.o /build/reproducible-path/cp2k-8.1/src/emd/rt_propagation_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_types.mod cp_cfm_types.mod qs_energy_types.mod input_constants.mod qs_ks_methods.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod kinds.mod cp_fm_vect.mod rt_propagation_output.mod qs_energy_init.mod cp_dbcsr_operations.mod ls_matrix_exp.mod cp_fm_basic_linalg.mod iterate_matrix.mod rt_propagation_utils.mod cp_dbcsr_cholesky.mod rt_make_propagators.mod bibliography.mod mathlib.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_restart_force_eval.o' due to: /build/reproducible-path/cp2k-8.1/src/input_restart_force_eval.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod eip_environment_types.mod cell_types.mod force_env_types.mod nnp_environment_types.mod parallel_rng_types.mod molecule_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod input_val_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod virial_types.mod cp_control_types.mod molecule_list_types.mod atomic_kind_list_types.mod multipole_types.mod kinds.mod message_passing.mod qmmm_ff_fist.mod string_utilities.mod input_cp2k_restarts_util.mod cp_files.mod base_hooks.mod cp_linked_list_input.mod input_constants.mod input_restart_rng.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_restart_force_eval.F input_restart_force_eval.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_restart_force_eval.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_restart_force_eval.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_restart_force_eval.mod' due to: input_restart_force_eval.o /build/reproducible-path/cp2k-8.1/src/input_restart_force_eval.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod eip_environment_types.mod cell_types.mod force_env_types.mod nnp_environment_types.mod parallel_rng_types.mod molecule_types.mod particle_list_types.mod atomic_kind_types.mod qs_environment_types.mod input_val_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod virial_types.mod cp_control_types.mod molecule_list_types.mod atomic_kind_list_types.mod multipole_types.mod kinds.mod message_passing.mod qmmm_ff_fist.mod string_utilities.mod input_cp2k_restarts_util.mod cp_files.mod base_hooks.mod cp_linked_list_input.mod input_constants.mod input_restart_rng.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gopt_param_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/gopt_param_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/gopt_param_types.F gopt_param_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/gopt_param_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gopt_param_types.F90 -/build/reproducible-path/cp2k-8.1/src/motion/gopt_param_types.F:167:31: - - 167 | SUBROUTINE gopt_param_retain(gopt_param) - | ^ -Warning: 'gopt_param_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'gopt_param_types.mod' due to: gopt_param_types.o /build/reproducible-path/cp2k-8.1/src/motion/gopt_param_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_constants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmmx_update.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmmx_update.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod cp_subsys_types.mod input_section_types.mod qmmmx_types.mod atomic_kind_list_types.mod distribution_1d_types.mod force_env_types.mod qmmmx_util.mod qmmm_create.mod input_restart_force_eval.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmmx_update.F qmmmx_update.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_update.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_update.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmmx_update.mod' due to: qmmmx_update.o /build/reproducible-path/cp2k-8.1/src/qmmmx_update.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmm_types.mod cp_subsys_types.mod input_section_types.mod qmmmx_types.mod atomic_kind_list_types.mod distribution_1d_types.mod force_env_types.mod qmmmx_util.mod qmmm_create.mod input_restart_force_eval.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'reftraj_util.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/reftraj_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod force_env_types.mod molecule_types.mod particle_list_types.mod reftraj_types.mod molecule_kind_list_types.mod atomic_kind_types.mod md_environment_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod molecule_list_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod util.mod cp_files.mod machine.mod base_hooks.mod cp_parser_methods.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/reftraj_util.F reftraj_util.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/reftraj_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' reftraj_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'reftraj_util.mod' due to: reftraj_util.o /build/reproducible-path/cp2k-8.1/src/motion/reftraj_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod force_env_types.mod molecule_types.mod particle_list_types.mod reftraj_types.mod molecule_kind_list_types.mod atomic_kind_types.mod md_environment_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod molecule_list_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod util.mod cp_files.mod machine.mod base_hooks.mod cp_parser_methods.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dimer_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/dimer_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod global_types.mod cell_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/dimer_types.F dimer_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/dimer_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dimer_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dimer_types.mod' due to: dimer_types.o /build/reproducible-path/cp2k-8.1/src/motion/dimer_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_kind_list_types.mod global_types.mod cell_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod input_constants.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cell_opt_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cell_opt_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cp_para_types.mod input_section_types.mod cell_types.mod input_enumeration_types.mod input_constants.mod mathlib.mod cp_log_handling.mod mathconstants.mod cp_files.mod base_hooks.mod input_cp2k_global.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cell_opt_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cell_opt_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod input_enumeration_types.mod input_section_types.mod input_keyword_types.mod mathlib.mod mathconstants.mod cp_log_handling.mod cp_files.mod kinds.mod base_hooks.mod input_cp2k_global.mod input_constants.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/cell_opt_utils.F cell_opt_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cell_opt_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_opt_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cell_opt_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_opt_utils.F90 /build/reproducible-path/cp2k-8.1/src/motion/cell_opt_utils.F:146:47: 146 | new_logger%iter_info%project_name = c_val | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cell_opt_utils.mod' due to: cell_opt_utils.o /build/reproducible-path/cp2k-8.1/src/motion/cell_opt_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cp_para_types.mod input_section_types.mod cell_types.mod input_enumeration_types.mod input_constants.mod mathlib.mod cp_log_handling.mod mathconstants.mod cp_files.mod base_hooks.mod input_cp2k_global.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cell_opt_utils.mod' due to: cell_opt_utils.o /build/reproducible-path/cp2k-8.1/src/motion/cell_opt_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod input_enumeration_types.mod input_section_types.mod input_keyword_types.mod mathlib.mod mathconstants.mod cp_log_handling.mod cp_files.mod kinds.mod base_hooks.mod input_cp2k_global.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cell_opt_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cell_opt_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod input_section_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod cell_opt_utils.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cell_opt_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cell_opt_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod particle_list_types.mod cell_types.mod force_env_types.mod cp_log_handling.mod cell_opt_utils.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/cell_opt_types.F cell_opt_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cell_opt_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_opt_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cell_opt_types.mod' due to: cell_opt_types.o /build/reproducible-path/cp2k-8.1/src/motion/cell_opt_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod input_section_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod cell_opt_utils.mod cp_units.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cell_opt_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_opt_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cell_opt_types.mod' due to: cell_opt_types.o /build/reproducible-path/cp2k-8.1/src/motion/cell_opt_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod particle_list_types.mod cell_types.mod force_env_types.mod cp_log_handling.mod cell_opt_utils.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dimer_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/dimer_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod global_types.mod molecule_kind_list_types.mod input_section_types.mod cp_subsys_types.mod cell_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/dimer_types.F dimer_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/dimer_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dimer_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dimer_types.mod' due to: dimer_types.o /build/reproducible-path/cp2k-8.1/src/motion/dimer_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod global_types.mod molecule_kind_list_types.mod input_section_types.mod cp_subsys_types.mod cell_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gopt_param_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/gopt_param_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod input_constants.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/gopt_param_types.F gopt_param_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/gopt_param_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gopt_param_types.F90 +/build/reproducible-path/cp2k-8.1/src/motion/gopt_param_types.F:167:31: + + 167 | SUBROUTINE gopt_param_retain(gopt_param) + | ^ +Warning: 'gopt_param_retain' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'gopt_param_types.mod' due to: gopt_param_types.o /build/reproducible-path/cp2k-8.1/src/motion/gopt_param_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod input_constants.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gopt_f_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/gopt_f_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_opt_types.mod global_types.mod input_section_types.mod cp_subsys_types.mod gopt_param_types.mod particle_list_types.mod force_env_types.mod dimer_types.mod input_constants.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gopt_f_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/gopt_f_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod particle_list_types.mod global_types.mod dimer_types.mod force_env_types.mod cell_opt_types.mod gopt_param_types.mod kinds.mod base_hooks.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/gopt_f_types.F gopt_f_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/gopt_f_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gopt_f_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'gopt_f_types.mod' due to: gopt_f_types.o /build/reproducible-path/cp2k-8.1/src/motion/gopt_f_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_opt_types.mod global_types.mod input_section_types.mod cp_subsys_types.mod gopt_param_types.mod particle_list_types.mod force_env_types.mod dimer_types.mod input_constants.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/gopt_f_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gopt_f_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'gopt_f_types.mod' due to: gopt_f_types.o /build/reproducible-path/cp2k-8.1/src/motion/gopt_f_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod particle_list_types.mod global_types.mod dimer_types.mod force_env_types.mod cell_opt_types.mod gopt_param_types.mod kinds.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dimer_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/dimer_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod dimer_types.mod cp_log_handling.mod base_hooks.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dimer_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/dimer_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dimer_types.mod input_section_types.mod cp_log_handling.mod kinds.mod memory_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/dimer_utils.F dimer_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/dimer_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dimer_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dimer_utils.mod' due to: dimer_utils.o /build/reproducible-path/cp2k-8.1/src/motion/dimer_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod dimer_types.mod cp_log_handling.mod base_hooks.mod kinds.mod memory_utilities.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/dimer_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dimer_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dimer_utils.mod' due to: dimer_utils.o /build/reproducible-path/cp2k-8.1/src/motion/dimer_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 dimer_types.mod input_section_types.mod cp_log_handling.mod kinds.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cg_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cg_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod gopt_param_types.mod gopt_f_types.mod dimer_types.mod input_constants.mod base_hooks.mod mathconstants.mod cp_external_control.mod dimer_utils.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cg_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cg_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod global_types.mod gopt_f_types.mod dimer_types.mod gopt_param_types.mod dimer_utils.mod cp_external_control.mod mathconstants.mod kinds.mod base_hooks.mod input_constants.mod memory_utilities.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/cg_utils.F cg_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cg_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cg_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cg_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cg_utils.F90 /build/reproducible-path/cp2k-8.1/src/motion/cg_utils.F:810:19: 810 | IF (ABS(d) .GT. ABS(0.5_dp*olde)) skip0 = .TRUE. | ^ Warning: 'e' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cg_utils.mod' due to: cg_utils.o /build/reproducible-path/cp2k-8.1/src/motion/cg_utils.F /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod gopt_param_types.mod gopt_f_types.mod dimer_types.mod input_constants.mod base_hooks.mod mathconstants.mod cp_external_control.mod dimer_utils.mod kinds.mod memory_utilities.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 gle_system_types.mod input_section_types.mod replica_types.mod parallel_rng_types.mod simpar_types.mod cp_log_handling.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/pint_types.F pint_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:53 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_types.mod' due to: pint_types.o /build/reproducible-path/cp2k-8.1/src/motion/pint_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 gle_system_types.mod input_section_types.mod replica_types.mod parallel_rng_types.mod simpar_types.mod cp_log_handling.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'neb_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/neb_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod force_env_types.mod input_constants.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/neb_types.F neb_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'neb_types.mod' due to: neb_types.o /build/reproducible-path/cp2k-8.1/src/motion/neb_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod force_env_types.mod input_constants.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cg_utils.mod' due to: cg_utils.o /build/reproducible-path/cp2k-8.1/src/motion/cg_utils.F /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod global_types.mod gopt_f_types.mod dimer_types.mod gopt_param_types.mod dimer_utils.mod cp_external_control.mod mathconstants.mod kinds.mod base_hooks.mod input_constants.mod memory_utilities.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod input_section_types.mod parallel_rng_types.mod cell_types.mod cp_log_handling.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod cell_types.mod input_section_types.mod splines_types.mod cp_log_handling.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/helium_types.F helium_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_types.F90 /build/reproducible-path/cp2k-8.1/src/motion/helium_types.F:383:41: 383 | SUBROUTINE helium_destroy_real_arr_ptr(real_arr_p) | ^ Warning: 'helium_destroy_real_arr_ptr' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_types.mod' due to: helium_types.o /build/reproducible-path/cp2k-8.1/src/motion/helium_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod input_section_types.mod parallel_rng_types.mod cell_types.mod cp_log_handling.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_types.mod' due to: helium_types.o /build/reproducible-path/cp2k-8.1/src/motion/helium_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod cell_types.mod input_section_types.mod splines_types.mod cp_log_handling.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'neb_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/neb_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod input_section_types.mod kinds.mod input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/neb_types.F neb_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'neb_types.mod' due to: neb_types.o /build/reproducible-path/cp2k-8.1/src/motion/neb_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 force_env_types.mod input_section_types.mod kinds.mod input_constants.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 replica_types.mod parallel_rng_types.mod simpar_types.mod gle_system_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/pint_types.F pint_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_types.mod' due to: pint_types.o /build/reproducible-path/cp2k-8.1/src/motion/pint_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 replica_types.mod parallel_rng_types.mod simpar_types.mod gle_system_types.mod input_section_types.mod cp_log_handling.mod kinds.mod base_hooks.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_staging.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_staging.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pint_types.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/pint_staging.F pint_staging.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_staging.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_staging.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_staging.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_staging.F90 /build/reproducible-path/cp2k-8.1/src/motion/pint_staging.F:96:28: 96 | SUBROUTINE staging_retain(staging_env) @@ -47554,181 +47609,161 @@ Warning: 'staging_retain' defined but not used [-Wunused-function] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_staging.mod' due to: pint_staging.o /build/reproducible-path/cp2k-8.1/src/motion/pint_staging.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pint_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_normalmode.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_normalmode.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pint_types.mod input_constants.mod base_hooks.mod mathconstants.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_normalmode.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_normalmode.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pint_types.mod mathconstants.mod kinds.mod input_constants.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/pint_normalmode.F pint_normalmode.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:14:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_normalmode.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_normalmode.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_normalmode.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_normalmode.F90 /build/reproducible-path/cp2k-8.1/src/motion/pint_normalmode.F:189:31: 189 | SUBROUTINE normalmode_retain(normalmode_env) | ^ Warning: 'normalmode_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_normalmode.mod' due to: pint_normalmode.o /build/reproducible-path/cp2k-8.1/src/motion/pint_normalmode.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pint_types.mod input_constants.mod base_hooks.mod mathconstants.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_normalmode.mod' due to: pint_normalmode.o /build/reproducible-path/cp2k-8.1/src/motion/pint_normalmode.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pint_types.mod mathconstants.mod kinds.mod input_constants.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_transformations.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_transformations.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pint_types.mod input_constants.mod pint_staging.mod base_hooks.mod pint_normalmode.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_transformations.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_transformations.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pint_types.mod pint_staging.mod pint_normalmode.mod kinds.mod input_constants.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/pint_transformations.F pint_transformations.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_transformations.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_transformations.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_transformations.mod' due to: pint_transformations.o /build/reproducible-path/cp2k-8.1/src/motion/pint_transformations.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pint_types.mod input_constants.mod pint_staging.mod base_hooks.mod pint_normalmode.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_restart_rng.o' due to: /build/reproducible-path/cp2k-8.1/src/input_restart_rng.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod parallel_rng_types.mod string_utilities.mod base_hooks.mod cp_linked_list_input.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_restart_rng.F input_restart_rng.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_restart_rng.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_restart_rng.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_restart_rng.mod' due to: input_restart_rng.o /build/reproducible-path/cp2k-8.1/src/input_restart_rng.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod parallel_rng_types.mod string_utilities.mod base_hooks.mod cp_linked_list_input.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_restart_force_eval.o' due to: /build/reproducible-path/cp2k-8.1/src/input_restart_force_eval.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod nnp_environment_types.mod parallel_rng_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod molecule_kind_types.mod eip_environment_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod molecule_list_types.mod multipole_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod input_constants.mod string_utilities.mod cp_files.mod kinds.mod qmmm_ff_fist.mod cp_linked_list_input.mod input_cp2k_restarts_util.mod input_restart_rng.mod message_passing.mod base_hooks.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_restart_force_eval.F input_restart_force_eval.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_restart_force_eval.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_restart_force_eval.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_restart_force_eval.mod' due to: input_restart_force_eval.o /build/reproducible-path/cp2k-8.1/src/input_restart_force_eval.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod nnp_environment_types.mod parallel_rng_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod molecule_kind_types.mod eip_environment_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod molecule_list_types.mod multipole_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod input_constants.mod string_utilities.mod cp_files.mod kinds.mod qmmm_ff_fist.mod cp_linked_list_input.mod input_cp2k_restarts_util.mod input_restart_rng.mod message_passing.mod base_hooks.mod cp_units.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_transformations.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_transformations.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_transformations.mod' due to: pint_transformations.o /build/reproducible-path/cp2k-8.1/src/motion/pint_transformations.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pint_types.mod pint_staging.mod pint_normalmode.mod kinds.mod input_constants.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_restarts.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/input_cp2k_restarts.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod csvr_system_types.mod molecule_kind_list_types.mod al_system_types.mod pint_types.mod parallel_rng_types.mod atomic_kind_list_types.mod gle_system_types.mod neb_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod md_environment_types.mod particle_types.mod averages_types.mod metadynamics_types.mod cp_subsys_types.mod simpar_types.mod particle_list_types.mod force_env_types.mod molecule_list_types.mod helium_types.mod input_section_types.mod input_constants.mod string_utilities.mod cp2k_info.mod pint_transformations.mod kinds.mod input_restart_force_eval.mod thermostat_utils.mod cp_output_handling.mod physcon.mod cp_linked_list_input.mod input_restart_rng.mod message_passing.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_restarts.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/input_cp2k_restarts.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod averages_types.mod gle_system_types.mod particle_types.mod force_env_types.mod parallel_rng_types.mod particle_list_types.mod al_system_types.mod thermostat_types.mod molecule_kind_list_types.mod helium_types.mod extended_system_types.mod neb_types.mod input_val_types.mod metadynamics_types.mod md_environment_types.mod input_section_types.mod molecule_list_types.mod simpar_types.mod atomic_kind_list_types.mod pint_types.mod csvr_system_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod string_utilities.mod cp2k_info.mod memory_utilities.mod input_restart_force_eval.mod base_hooks.mod pint_transformations.mod cp_linked_list_input.mod input_constants.mod input_restart_rng.mod thermostat_utils.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/input_cp2k_restarts.F input_cp2k_restarts.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/input_cp2k_restarts.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_restarts.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_restarts.mod' due to: input_cp2k_restarts.o /build/reproducible-path/cp2k-8.1/src/motion/input_cp2k_restarts.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod csvr_system_types.mod molecule_kind_list_types.mod al_system_types.mod pint_types.mod parallel_rng_types.mod atomic_kind_list_types.mod gle_system_types.mod neb_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod md_environment_types.mod particle_types.mod averages_types.mod metadynamics_types.mod cp_subsys_types.mod simpar_types.mod particle_list_types.mod force_env_types.mod molecule_list_types.mod helium_types.mod input_section_types.mod input_constants.mod string_utilities.mod cp2k_info.mod pint_transformations.mod kinds.mod input_restart_force_eval.mod thermostat_utils.mod cp_output_handling.mod physcon.mod cp_linked_list_input.mod input_restart_rng.mod message_passing.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/input_cp2k_restarts.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_restarts.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_restarts.mod' due to: input_cp2k_restarts.o /build/reproducible-path/cp2k-8.1/src/motion/input_cp2k_restarts.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod averages_types.mod gle_system_types.mod particle_types.mod force_env_types.mod parallel_rng_types.mod particle_list_types.mod al_system_types.mod thermostat_types.mod molecule_kind_list_types.mod helium_types.mod extended_system_types.mod neb_types.mod input_val_types.mod metadynamics_types.mod md_environment_types.mod input_section_types.mod molecule_list_types.mod simpar_types.mod atomic_kind_list_types.mod pint_types.mod csvr_system_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod message_passing.mod string_utilities.mod cp2k_info.mod memory_utilities.mod input_restart_force_eval.mod base_hooks.mod pint_transformations.mod cp_linked_list_input.mod input_constants.mod input_restart_rng.mod thermostat_utils.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gopt_f_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/gopt_f_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 gopt_param_types.mod cell_types.mod dimer_types.mod atomic_kind_list_types.mod cp_para_types.mod virial_types.mod gopt_f_types.mod particle_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod qmmmx_util.mod kinds.mod qmmm_util.mod motion_utils.mod dimer_utils.mod virial_methods.mod particle_methods.mod cp_log_handling.mod base_hooks.mod machine.mod cp_units.mod input_cp2k_restarts.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gopt_f_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/gopt_f_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod gopt_f_types.mod cell_types.mod particle_types.mod force_env_types.mod particle_list_types.mod atomic_kind_types.mod distribution_1d_types.mod dimer_types.mod input_section_types.mod gopt_param_types.mod virial_types.mod atomic_kind_list_types.mod dimer_utils.mod qmmmx_util.mod cp_log_handling.mod kinds.mod qmmm_util.mod virial_methods.mod input_cp2k_restarts.mod motion_utils.mod particle_methods.mod machine.mod base_hooks.mod input_constants.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/gopt_f_methods.F gopt_f_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/gopt_f_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gopt_f_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/gopt_f_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gopt_f_methods.F90 /build/reproducible-path/cp2k-8.1/src/motion/gopt_f_methods.F:978:14: 978 | CPASSERT((SIZE(x) == idg + 6)) | ^ Warning: 'idg' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'gopt_f_methods.mod' due to: gopt_f_methods.o /build/reproducible-path/cp2k-8.1/src/motion/gopt_f_methods.F /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 gopt_param_types.mod cell_types.mod dimer_types.mod atomic_kind_list_types.mod cp_para_types.mod virial_types.mod gopt_f_types.mod particle_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod qmmmx_util.mod kinds.mod qmmm_util.mod motion_utils.mod dimer_utils.mod virial_methods.mod particle_methods.mod cp_log_handling.mod base_hooks.mod machine.mod cp_units.mod input_cp2k_restarts.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'gopt_f_methods.mod' due to: gopt_f_methods.o /build/reproducible-path/cp2k-8.1/src/motion/gopt_f_methods.F /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod gopt_f_types.mod cell_types.mod particle_types.mod force_env_types.mod particle_list_types.mod atomic_kind_types.mod distribution_1d_types.mod dimer_types.mod input_section_types.mod gopt_param_types.mod virial_types.mod atomic_kind_list_types.mod dimer_utils.mod qmmmx_util.mod cp_log_handling.mod kinds.mod qmmm_util.mod virial_methods.mod input_cp2k_restarts.mod motion_utils.mod particle_methods.mod machine.mod base_hooks.mod input_constants.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cg_optimizer.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cg_optimizer.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod input_section_types.mod gopt_param_types.mod gopt_f_types.mod force_env_types.mod cell_types.mod cp_log_handling.mod cg_utils.mod base_hooks.mod cp_external_control.mod cp_output_handling.mod gopt_f_methods.mod machine.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cg_optimizer.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cg_optimizer.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod global_types.mod gopt_f_types.mod cell_types.mod force_env_types.mod gopt_param_types.mod cp_external_control.mod cp_log_handling.mod cg_utils.mod gopt_f_methods.mod kinds.mod base_hooks.mod cp_output_handling.mod machine.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/cg_optimizer.F cg_optimizer.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cg_optimizer.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cg_optimizer.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cg_optimizer.mod' due to: cg_optimizer.o /build/reproducible-path/cp2k-8.1/src/motion/cg_optimizer.F /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod input_section_types.mod gopt_param_types.mod gopt_f_types.mod force_env_types.mod cell_types.mod cp_log_handling.mod cg_utils.mod base_hooks.mod cp_external_control.mod cp_output_handling.mod gopt_f_methods.mod machine.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'integrator_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/integrator_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod cp_para_types.mod extended_system_types.mod virial_types.mod thermostat_types.mod md_environment_types.mod particle_types.mod molecule_kind_types.mod barostat_types.mod simpar_types.mod distribution_1d_types.mod atomic_kind_types.mod molecule_types.mod input_constants.mod kinds.mod message_passing.mod mathlib.mod constraint.mod base_hooks.mod constraint_util.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/integrator_utils.F integrator_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/integrator_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' integrator_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'integrator_utils.mod' due to: integrator_utils.o /build/reproducible-path/cp2k-8.1/src/motion/integrator_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod cp_para_types.mod extended_system_types.mod virial_types.mod thermostat_types.mod md_environment_types.mod particle_types.mod molecule_kind_types.mod barostat_types.mod simpar_types.mod distribution_1d_types.mod atomic_kind_types.mod molecule_types.mod input_constants.mod kinds.mod message_passing.mod mathlib.mod constraint.mod base_hooks.mod constraint_util.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cg_optimizer.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cg_optimizer.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cg_optimizer.mod' due to: cg_optimizer.o /build/reproducible-path/cp2k-8.1/src/motion/cg_optimizer.F /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod global_types.mod gopt_f_types.mod cell_types.mod force_env_types.mod gopt_param_types.mod cp_external_control.mod cp_log_handling.mod cg_utils.mod gopt_f_methods.mod kinds.mod base_hooks.mod cp_output_handling.mod machine.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'shell_opt.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/shell_opt.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod gopt_param_types.mod atomic_kind_list_types.mod cp_para_types.mod gopt_f_types.mod particle_types.mod cp_subsys_types.mod force_env_types.mod distribution_1d_types.mod global_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod kinds.mod cp_output_handling.mod message_passing.mod cg_optimizer.mod integrator_utils.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'shell_opt.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/shell_opt.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod gopt_f_types.mod particle_types.mod force_env_types.mod global_types.mod atomic_kind_types.mod distribution_1d_types.mod input_section_types.mod gopt_param_types.mod shell_potential_types.mod atomic_kind_list_types.mod cg_optimizer.mod cp_log_handling.mod kinds.mod cp_output_handling.mod message_passing.mod integrator_utils.mod base_hooks.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/shell_opt.F shell_opt.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/shell_opt.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' shell_opt.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'shell_opt.mod' due to: shell_opt.o /build/reproducible-path/cp2k-8.1/src/motion/shell_opt.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod gopt_param_types.mod atomic_kind_list_types.mod cp_para_types.mod gopt_f_types.mod particle_types.mod cp_subsys_types.mod force_env_types.mod distribution_1d_types.mod global_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod kinds.mod cp_output_handling.mod message_passing.mod cg_optimizer.mod integrator_utils.mod cp_log_handling.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/shell_opt.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' shell_opt.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'shell_opt.mod' due to: shell_opt.o /build/reproducible-path/cp2k-8.1/src/motion/shell_opt.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod gopt_f_types.mod particle_types.mod force_env_types.mod global_types.mod atomic_kind_types.mod distribution_1d_types.mod input_section_types.mod gopt_param_types.mod shell_potential_types.mod atomic_kind_list_types.mod cg_optimizer.mod cp_log_handling.mod kinds.mod cp_output_handling.mod message_passing.mod integrator_utils.mod base_hooks.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gle_system_dynamics.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/gle_system_dynamics.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod extended_system_types.mod molecule_types.mod simpar_types.mod thermostat_types.mod gle_system_types.mod particle_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod message_passing.mod kinds.mod thermostat_mapping.mod input_constants.mod thermostat_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/gle_system_dynamics.F gle_system_dynamics.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:37 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/gle_system_dynamics.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gle_system_dynamics.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'gle_system_dynamics.mod' due to: gle_system_dynamics.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/gle_system_dynamics.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod extended_system_types.mod molecule_types.mod simpar_types.mod thermostat_types.mod gle_system_types.mod particle_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod message_passing.mod kinds.mod thermostat_mapping.mod input_constants.mod thermostat_utils.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'csvr_system_mapping.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_mapping.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod csvr_system_types.mod molecule_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod simpar_types.mod distribution_1d_types.mod input_constants.mod thermostat_mapping.mod base_hooks.mod message_passing.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'csvr_system_mapping.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_mapping.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod molecule_kind_types.mod molecule_types.mod simpar_types.mod thermostat_types.mod distribution_1d_types.mod csvr_system_types.mod message_passing.mod kinds.mod thermostat_mapping.mod input_constants.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_mapping.F csvr_system_mapping.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/csvr_system_mapping.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_mapping.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'csvr_system_mapping.mod' due to: csvr_system_mapping.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_mapping.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod csvr_system_types.mod molecule_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod simpar_types.mod distribution_1d_types.mod input_constants.mod thermostat_mapping.mod base_hooks.mod message_passing.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:40 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/csvr_system_mapping.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_mapping.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'csvr_system_mapping.mod' due to: csvr_system_mapping.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_mapping.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod molecule_kind_types.mod molecule_types.mod simpar_types.mod thermostat_types.mod distribution_1d_types.mod csvr_system_types.mod message_passing.mod kinds.mod thermostat_mapping.mod input_constants.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'csvr_system_init.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod csvr_system_types.mod cp_para_types.mod input_section_types.mod thermostat_types.mod simpar_types.mod parallel_rng_types.mod distribution_1d_types.mod molecule_types.mod base_hooks.mod csvr_system_mapping.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'csvr_system_init.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod molecule_kind_types.mod molecule_types.mod simpar_types.mod thermostat_types.mod distribution_1d_types.mod input_section_types.mod csvr_system_types.mod base_hooks.mod csvr_system_mapping.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_init.F csvr_system_init.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/csvr_system_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_init.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'csvr_system_init.mod' due to: csvr_system_init.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod csvr_system_types.mod cp_para_types.mod input_section_types.mod thermostat_types.mod simpar_types.mod parallel_rng_types.mod distribution_1d_types.mod molecule_types.mod base_hooks.mod csvr_system_mapping.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'al_system_mapping.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_mapping.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod al_system_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod simpar_types.mod distribution_1d_types.mod input_constants.mod thermostat_mapping.mod message_passing.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_mapping.F al_system_mapping.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:41 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/al_system_mapping.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' al_system_mapping.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'al_system_mapping.mod' due to: al_system_mapping.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_mapping.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod al_system_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod simpar_types.mod distribution_1d_types.mod input_constants.mod thermostat_mapping.mod message_passing.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'al_system_init.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod al_system_types.mod cp_para_types.mod input_section_types.mod thermostat_types.mod simpar_types.mod distribution_1d_types.mod al_system_mapping.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_init.F al_system_init.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/al_system_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' al_system_init.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'al_system_init.mod' due to: al_system_init.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod al_system_types.mod cp_para_types.mod input_section_types.mod thermostat_types.mod simpar_types.mod distribution_1d_types.mod al_system_mapping.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:40 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/csvr_system_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_init.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'csvr_system_init.mod' due to: csvr_system_init.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod molecule_kind_types.mod molecule_types.mod simpar_types.mod thermostat_types.mod distribution_1d_types.mod input_section_types.mod csvr_system_types.mod base_hooks.mod csvr_system_mapping.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gle_system_dynamics.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/gle_system_dynamics.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod gle_system_types.mod cp_para_types.mod extended_system_types.mod input_section_types.mod particle_types.mod thermostat_types.mod simpar_types.mod parallel_rng_types.mod distribution_1d_types.mod input_constants.mod thermostat_mapping.mod message_passing.mod thermostat_utils.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/gle_system_dynamics.F gle_system_dynamics.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/gle_system_dynamics.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gle_system_dynamics.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'gle_system_dynamics.mod' due to: gle_system_dynamics.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/gle_system_dynamics.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod gle_system_types.mod cp_para_types.mod extended_system_types.mod input_section_types.mod particle_types.mod thermostat_types.mod simpar_types.mod parallel_rng_types.mod distribution_1d_types.mod input_constants.mod thermostat_mapping.mod message_passing.mod thermostat_utils.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'csvr_system_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/csvr_system_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/csvr_system_utils.F csvr_system_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"csvr_system_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'csvr_system_utils.mod' due to: csvr_system_utils.o /build/reproducible-path/cp2k-8.1/src/csvr_system_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'extended_system_dynamics.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_dynamics.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod shell_potential_types.mod extended_system_types.mod particle_types.mod distribution_1d_types.mod thermostat_utils.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_dynamics.F extended_system_dynamics.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:47 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/extended_system_dynamics.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' extended_system_dynamics.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'extended_system_dynamics.mod' due to: extended_system_dynamics.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/extended_system_dynamics.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod shell_potential_types.mod extended_system_types.mod particle_types.mod distribution_1d_types.mod thermostat_utils.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'csvr_system_dynamics.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_dynamics.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod extended_system_types.mod molecule_kind_types.mod molecule_types.mod particle_types.mod distribution_1d_types.mod csvr_system_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod csvr_system_utils.mod thermostat_utils.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_dynamics.F csvr_system_dynamics.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/csvr_system_dynamics.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_dynamics.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'csvr_system_dynamics.mod' due to: csvr_system_dynamics.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_dynamics.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod extended_system_types.mod molecule_kind_types.mod molecule_types.mod particle_types.mod distribution_1d_types.mod csvr_system_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod csvr_system_utils.mod thermostat_utils.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'al_system_dynamics.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_dynamics.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod al_system_types.mod extended_system_types.mod particle_types.mod force_env_types.mod distribution_1d_types.mod thermostat_utils.mod base_hooks.mod constraint_fxd.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'al_system_dynamics.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_dynamics.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod molecule_types.mod al_system_types.mod particle_types.mod distribution_1d_types.mod force_env_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod thermostat_utils.mod constraint_fxd.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_dynamics.F al_system_dynamics.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/al_system_dynamics.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' al_system_dynamics.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/al_system_dynamics.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' al_system_dynamics.F90 /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_dynamics.F:290:46: 290 | map_info%v_scale(imap) = 1.0_dp | ^ Warning: 'imap' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'al_system_dynamics.mod' due to: al_system_dynamics.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_dynamics.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod atomic_kind_types.mod al_system_types.mod extended_system_types.mod particle_types.mod force_env_types.mod distribution_1d_types.mod thermostat_utils.mod base_hooks.mod constraint_fxd.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'al_system_dynamics.mod' due to: al_system_dynamics.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_dynamics.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod molecule_types.mod al_system_types.mod particle_types.mod distribution_1d_types.mod force_env_types.mod molecule_kind_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod thermostat_utils.mod constraint_fxd.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'csvr_system_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/csvr_system_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/csvr_system_utils.F csvr_system_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"csvr_system_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'csvr_system_utils.mod' due to: csvr_system_utils.o /build/reproducible-path/cp2k-8.1/src/csvr_system_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'al_system_mapping.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_mapping.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod molecule_types.mod simpar_types.mod al_system_types.mod thermostat_types.mod distribution_1d_types.mod molecule_kind_types.mod message_passing.mod kinds.mod thermostat_mapping.mod input_constants.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_mapping.F al_system_mapping.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:43 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/al_system_mapping.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' al_system_mapping.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'al_system_mapping.mod' due to: al_system_mapping.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_mapping.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod extended_system_types.mod molecule_types.mod simpar_types.mod al_system_types.mod thermostat_types.mod distribution_1d_types.mod molecule_kind_types.mod message_passing.mod kinds.mod thermostat_mapping.mod input_constants.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'csvr_system_dynamics.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_dynamics.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod csvr_system_types.mod molecule_types.mod atomic_kind_types.mod extended_system_types.mod particle_types.mod parallel_rng_types.mod distribution_1d_types.mod csvr_system_utils.mod thermostat_utils.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_dynamics.F csvr_system_dynamics.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/csvr_system_dynamics.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' csvr_system_dynamics.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'csvr_system_dynamics.mod' due to: csvr_system_dynamics.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/csvr_system_dynamics.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod csvr_system_types.mod molecule_types.mod atomic_kind_types.mod extended_system_types.mod particle_types.mod parallel_rng_types.mod distribution_1d_types.mod csvr_system_utils.mod thermostat_utils.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'al_system_init.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod molecule_types.mod simpar_types.mod al_system_types.mod thermostat_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod kinds.mod al_system_mapping.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_init.F al_system_init.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/al_system_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' al_system_init.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'al_system_init.mod' due to: al_system_init.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/al_system_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod molecule_types.mod simpar_types.mod al_system_types.mod thermostat_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod kinds.mod al_system_mapping.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'thermostat_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod simpar_types.mod force_env_types.mod particle_list_types.mod distribution_1d_types.mod global_types.mod molecule_list_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types.mod molecule_types.mod input_constants.mod csvr_system_init.mod kinds.mod thermostat_utils.mod extended_system_init.mod cp_output_handling.mod al_system_init.mod gle_system_dynamics.mod bibliography.mod extended_system_dynamics.mod cp_log_handling.mod base_hooks.mod al_system_dynamics.mod cp_units.mod csvr_system_dynamics.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'thermostat_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod cell_types.mod force_env_types.mod molecule_types.mod particle_list_types.mod global_types.mod thermostat_types.mod molecule_kind_list_types.mod atomic_kind_types.mod extended_system_types.mod qmmm_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod molecule_list_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod gle_system_dynamics.mod extended_system_dynamics.mod cp_output_handling.mod bibliography.mod csvr_system_init.mod csvr_system_dynamics.mod al_system_dynamics.mod base_hooks.mod extended_system_init.mod al_system_init.mod input_constants.mod thermostat_utils.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_methods.F thermostat_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/thermostat_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermostat_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'thermostat_methods.mod' due to: thermostat_methods.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod simpar_types.mod force_env_types.mod particle_list_types.mod distribution_1d_types.mod global_types.mod molecule_list_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types.mod molecule_types.mod input_constants.mod csvr_system_init.mod kinds.mod thermostat_utils.mod extended_system_init.mod cp_output_handling.mod al_system_init.mod gle_system_dynamics.mod bibliography.mod extended_system_dynamics.mod cp_log_handling.mod base_hooks.mod al_system_dynamics.mod cp_units.mod csvr_system_dynamics.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'reftraj_util.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/reftraj_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_list_types.mod cp_para_types.mod md_environment_types.mod particle_types.mod reftraj_types.mod molecule_kind_types.mod cp_subsys_types.mod simpar_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod molecule_list_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod cp_files.mod util.mod kinds.mod cp_output_handling.mod physcon.mod cp_parser_methods.mod message_passing.mod cp_log_handling.mod base_hooks.mod machine.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/reftraj_util.F reftraj_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:15:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/reftraj_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' reftraj_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'reftraj_util.mod' due to: reftraj_util.o /build/reproducible-path/cp2k-8.1/src/motion/reftraj_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod atomic_kind_list_types.mod cp_para_types.mod md_environment_types.mod particle_types.mod reftraj_types.mod molecule_kind_types.mod cp_subsys_types.mod simpar_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod molecule_list_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod cp_files.mod util.mod kinds.mod cp_output_handling.mod physcon.mod cp_parser_methods.mod message_passing.mod cp_log_handling.mod base_hooks.mod machine.mod cp_units.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/thermostat_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermostat_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'thermostat_methods.mod' due to: thermostat_methods.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/thermostat_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod cell_types.mod force_env_types.mod molecule_types.mod particle_list_types.mod global_types.mod thermostat_types.mod molecule_kind_list_types.mod atomic_kind_types.mod extended_system_types.mod qmmm_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod molecule_list_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod gle_system_dynamics.mod extended_system_dynamics.mod cp_output_handling.mod bibliography.mod csvr_system_init.mod csvr_system_dynamics.mod al_system_dynamics.mod base_hooks.mod extended_system_init.mod al_system_init.mod input_constants.mod thermostat_utils.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qmmmx_update.o' due to: /build/reproducible-path/cp2k-8.1/src/qmmmx_update.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmmx_types.mod input_section_types.mod cp_subsys_types.mod qmmm_types.mod force_env_types.mod atomic_kind_list_types.mod distribution_1d_types.mod qmmmx_util.mod input_restart_force_eval.mod base_hooks.mod qmmm_create.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qmmmx_update.F qmmmx_update.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qmmmx_update.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qmmmx_update.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qmmmx_update.mod' due to: qmmmx_update.o /build/reproducible-path/cp2k-8.1/src/qmmmx_update.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qmmmx_types.mod input_section_types.mod cp_subsys_types.mod qmmm_types.mod force_env_types.mod atomic_kind_list_types.mod distribution_1d_types.mod qmmmx_util.mod input_restart_force_eval.mod base_hooks.mod qmmm_create.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'metadynamics.o' due to: /build/reproducible-path/cp2k-8.1/src/metadynamics.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cell_types.mod force_env_types.mod colvar_types.mod particle_list_types.mod metadynamics_types.mod input_section_types.mod simpar_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod reference_manager.mod bibliography.mod message_passing.mod constraint_fxd.mod metadynamics_utils.mod base_hooks.mod input_constants.mod colvar_methods.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/metadynamics.F metadynamics.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"metadynamics.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' metadynamics.F90 +/build/reproducible-path/cp2k-8.1/src/metadynamics.F:603:22: + + 603 | IF (scal*check_val > 0.0_dp) CYCLE + | ^ +Warning: 'check_val' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'metadynamics.mod' due to: metadynamics.o /build/reproducible-path/cp2k-8.1/src/metadynamics.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cell_types.mod force_env_types.mod colvar_types.mod particle_list_types.mod metadynamics_types.mod input_section_types.mod simpar_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod reference_manager.mod bibliography.mod message_passing.mod constraint_fxd.mod metadynamics_utils.mod base_hooks.mod input_constants.mod colvar_methods.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'integrator.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/integrator.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod extended_system_types.mod virial_types.mod thermostat_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod md_environment_types.mod particle_types.mod reftraj_types.mod molecule_kind_types.mod thermal_region_types.mod barostat_types.mod cp_subsys_types.mod simpar_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod global_types.mod molecule_list_types.mod atomic_kind_types.mod molecule_types.mod input_constants.mod metadynamics.mod constraint_fxd.mod kinds.mod qmmm_util.mod virial_methods.mod rt_propagation_output.mod force_env_methods.mod physcon.mod rt_propagation_methods.mod shell_opt.mod cp_parser_methods.mod thermostat_methods.mod eigenvalueproblems.mod extended_system_dynamics.mod integrator_utils.mod mathlib.mod constraint.mod cp_log_handling.mod base_hooks.mod reftraj_util.mod constraint_util.mod cp_units.mod qmmmx_update.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'integrator.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/integrator.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod cell_types.mod force_env_types.mod thermal_region_types.mod molecule_types.mod barostat_types.mod particle_list_types.mod global_types.mod reftraj_types.mod thermostat_types.mod rt_propagation_types.mod molecule_kind_list_types.mod atomic_kind_types.mod qs_environment_types.mod extended_system_types.mod md_environment_types.mod distribution_1d_types.mod molecule_kind_types.mod virial_types.mod cp_control_types.mod molecule_list_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod extended_system_dynamics.mod physcon.mod qmmm_util.mod virial_methods.mod integrator_utils.mod eigenvalueproblems.mod rt_propagation_methods.mod qmmmx_update.mod force_env_methods.mod constraint_fxd.mod mathlib.mod reftraj_util.mod shell_opt.mod constraint_util.mod thermostat_methods.mod constraint.mod base_hooks.mod rt_propagation_output.mod input_constants.mod metadynamics.mod cp_parser_methods.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/integrator.F integrator.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/integrator.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' integrator.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/integrator.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' integrator.F90 /build/reproducible-path/cp2k-8.1/src/motion/integrator.F:396:65: 396 | REAL(KIND=dp), ALLOCATABLE, DIMENSION(:, :) :: v_old | ^ Warning: 'v_old.dim[1].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'integrator.mod' due to: integrator.o /build/reproducible-path/cp2k-8.1/src/motion/integrator.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod extended_system_types.mod virial_types.mod thermostat_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod md_environment_types.mod particle_types.mod reftraj_types.mod molecule_kind_types.mod thermal_region_types.mod barostat_types.mod cp_subsys_types.mod simpar_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod global_types.mod molecule_list_types.mod atomic_kind_types.mod molecule_types.mod input_constants.mod metadynamics.mod constraint_fxd.mod kinds.mod qmmm_util.mod virial_methods.mod rt_propagation_output.mod force_env_methods.mod physcon.mod rt_propagation_methods.mod shell_opt.mod cp_parser_methods.mod thermostat_methods.mod eigenvalueproblems.mod extended_system_dynamics.mod integrator_utils.mod mathlib.mod constraint.mod cp_log_handling.mod base_hooks.mod reftraj_util.mod constraint_util.mod cp_units.mod qmmmx_update.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'integrator.mod' due to: integrator.o /build/reproducible-path/cp2k-8.1/src/motion/integrator.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod cell_types.mod force_env_types.mod thermal_region_types.mod molecule_types.mod barostat_types.mod particle_list_types.mod global_types.mod reftraj_types.mod thermostat_types.mod rt_propagation_types.mod molecule_kind_list_types.mod atomic_kind_types.mod qs_environment_types.mod extended_system_types.mod md_environment_types.mod distribution_1d_types.mod molecule_kind_types.mod virial_types.mod cp_control_types.mod molecule_list_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod extended_system_dynamics.mod physcon.mod qmmm_util.mod virial_methods.mod integrator_utils.mod eigenvalueproblems.mod rt_propagation_methods.mod qmmmx_update.mod force_env_methods.mod constraint_fxd.mod mathlib.mod reftraj_util.mod shell_opt.mod constraint_util.mod thermostat_methods.mod constraint.mod base_hooks.mod rt_propagation_output.mod input_constants.mod metadynamics.mod cp_parser_methods.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'velocity_verlet_control.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/velocity_verlet_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod simpar_types.mod force_env_types.mod md_environment_types.mod input_constants.mod base_hooks.mod integrator.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'velocity_verlet_control.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/velocity_verlet_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 md_environment_types.mod global_types.mod simpar_types.mod force_env_types.mod integrator.mod input_constants.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/velocity_verlet_control.F velocity_verlet_control.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/velocity_verlet_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' velocity_verlet_control.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'thermal_region_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermal_region_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_subsys_types.mod simpar_types.mod thermal_region_types.mod force_env_types.mod particle_list_types.mod input_constants.mod string_utilities.mod cp_log_handling.mod base_hooks.mod bibliography.mod cp_output_handling.mod physcon.mod kinds.mod memory_utilities.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/velocity_verlet_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' velocity_verlet_control.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'thermal_region_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermal_region_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod particle_list_types.mod simpar_types.mod force_env_types.mod thermal_region_types.mod cp_log_handling.mod kinds.mod input_constants.mod physcon.mod cp_output_handling.mod memory_utilities.mod string_utilities.mod bibliography.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermal_region_utils.F thermal_region_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermal_region_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermal_region_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_thermostats.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_thermostats.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod input_cp2k_subsys.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermal_region_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' thermal_region_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_thermostats.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_thermostats.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod input_cp2k_subsys.mod string_utilities.mod bibliography.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_thermostats.F input_cp2k_thermostats.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_thermostats.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_thermostats.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_thermostats.mod' due to: input_cp2k_thermostats.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_thermostats.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod input_cp2k_subsys.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_thermostats.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_thermostats.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_thermostats.mod' due to: input_cp2k_thermostats.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_thermostats.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod input_cp2k_subsys.mod string_utilities.mod bibliography.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_barostats.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/input_cp2k_barostats.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod barostat_types.mod input_section_types.mod string_utilities.mod base_hooks.mod input_cp2k_thermostats.mod cp_output_handling.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_barostats.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/input_cp2k_barostats.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod barostat_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_cp2k_thermostats.mod cp_output_handling.mod string_utilities.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/input_cp2k_barostats.F input_cp2k_barostats.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/input_cp2k_barostats.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_barostats.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_barostats.mod' due to: input_cp2k_barostats.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/input_cp2k_barostats.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod barostat_types.mod input_section_types.mod string_utilities.mod base_hooks.mod input_cp2k_thermostats.mod cp_output_handling.mod cp_units.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:17:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/input_cp2k_barostats.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_barostats.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_barostats.mod' due to: input_cp2k_barostats.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/input_cp2k_barostats.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod barostat_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_cp2k_thermostats.mod cp_output_handling.mod string_utilities.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_md.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/input_cp2k_md.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod input_cp2k_thermostats.mod input_cp2k_barostats.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_md.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/input_cp2k_md.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod input_cp2k_thermostats.mod cp_output_handling.mod input_cp2k_barostats.mod string_utilities.mod bibliography.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/input_cp2k_md.F input_cp2k_md.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/input_cp2k_md.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_md.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_md.mod' due to: input_cp2k_md.o /build/reproducible-path/cp2k-8.1/src/motion/input_cp2k_md.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod input_cp2k_thermostats.mod input_cp2k_barostats.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/input_cp2k_md.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_md.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_md.mod' due to: input_cp2k_md.o /build/reproducible-path/cp2k-8.1/src/motion/input_cp2k_md.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod input_cp2k_thermostats.mod cp_output_handling.mod input_cp2k_barostats.mod string_utilities.mod bibliography.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'simpar_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/simpar_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_section_types.mod simpar_types.mod input_enumeration_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod input_cp2k_md.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'simpar_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/simpar_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 simpar_types.mod input_enumeration_types.mod input_section_types.mod input_keyword_types.mod cp_log_handling.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod input_cp2k_md.mod bibliography.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/simpar_methods.F simpar_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/simpar_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' simpar_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_hfx_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_hfx_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod qs_ks_types.mod base_hooks.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/simpar_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' simpar_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagator_init.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_propagator_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod arnoldi_api.mod cp_dbcsr_operations.mod rt_propagation_methods.mod cp_fm_basic_linalg.mod matrix_exp.mod iterate_matrix.mod rt_make_propagators.mod base_hooks.mod cp_fm_diag.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/emd/rt_propagator_init.F rt_propagator_init.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_propagator_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagator_init.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagator_init.mod' due to: rt_propagator_init.o /build/reproducible-path/cp2k-8.1/src/emd/rt_propagator_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod arnoldi_api.mod cp_dbcsr_operations.mod rt_propagation_methods.mod cp_fm_basic_linalg.mod matrix_exp.mod iterate_matrix.mod rt_make_propagators.mod base_hooks.mod cp_fm_diag.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_hfx_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_hfx_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_neighbor_list_types.mod qs_ks_types.mod cp_control_types.mod qs_rho_types.mod rt_propagation_types.mod kinds.mod base_hooks.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/emd/rt_hfx_utils.F rt_hfx_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_hfx_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_hfx_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_hfx_utils.mod' due to: rt_hfx_utils.o /build/reproducible-path/cp2k-8.1/src/emd/rt_hfx_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_neighbor_list_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod qs_ks_types.mod base_hooks.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:04 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_hfx_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_hfx_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_hfx_utils.mod' due to: rt_hfx_utils.o /build/reproducible-path/cp2k-8.1/src/emd/rt_hfx_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod qs_neighbor_list_types.mod qs_ks_types.mod cp_control_types.mod qs_rho_types.mod rt_propagation_types.mod kinds.mod base_hooks.mod cp_dbcsr_cp2k_link.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_delta_pulse.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_delta_pulse.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod cp_cfm_types.mod input_section_types.mod mathconstants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod cp_fm_struct.mod cp_cfm_diag.mod kinds.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod commutator_rpnl.mod cp_dbcsr_cp2k_link.mod cp_fm_cholesky.mod base_hooks.mod qs_moments.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_delta_pulse.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_delta_pulse.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod qs_mo_types.mod rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod cp_cfm_types.mod cp_control_types.mod kinds.mod cp_gemm_interface.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_moments.mod cp_dbcsr_operations.mod cp_cfm_basic_linalg.mod cp_fm_cholesky.mod cp_cfm_diag.mod cp_fm_basic_linalg.mod base_hooks.mod mathconstants.mod commutator_rpnl.mod cp_fm_diag.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/emd/rt_delta_pulse.F rt_delta_pulse.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_delta_pulse.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_delta_pulse.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_delta_pulse.mod' due to: rt_delta_pulse.o /build/reproducible-path/cp2k-8.1/src/emd/rt_delta_pulse.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_neighbor_list_types.mod cell_types.mod qs_mo_types.mod qs_kind_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_fm_types.mod cp_cfm_types.mod input_section_types.mod mathconstants.mod cp_gemm_interface.mod cp_cfm_basic_linalg.mod cp_fm_diag.mod cp_fm_struct.mod cp_cfm_diag.mod kinds.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod commutator_rpnl.mod cp_dbcsr_cp2k_link.mod cp_fm_cholesky.mod base_hooks.mod qs_moments.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagator_init.o' due to: /build/reproducible-path/cp2k-8.1/src/emd/rt_propagator_init.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_types.mod input_constants.mod arnoldi_api.mod cp_gemm_interface.mod cp_fm_diag.mod kinds.mod cp_dbcsr_operations.mod rt_propagation_methods.mod cp_fm_basic_linalg.mod iterate_matrix.mod rt_make_propagators.mod matrix_exp.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/emd/rt_propagator_init.F rt_propagator_init.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_propagator_init.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagator_init.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagator_init.mod' due to: rt_propagator_init.o /build/reproducible-path/cp2k-8.1/src/emd/rt_propagator_init.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_mo_types.mod rt_propagation_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_types.mod input_constants.mod arnoldi_api.mod cp_gemm_interface.mod cp_fm_diag.mod kinds.mod cp_dbcsr_operations.mod rt_propagation_methods.mod cp_fm_basic_linalg.mod iterate_matrix.mod rt_make_propagators.mod matrix_exp.mod cp_log_handling.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"emd/rt_delta_pulse.F\"" -I'/build/reproducible-path/cp2k-8.1/src/emd/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_delta_pulse.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_delta_pulse.mod' due to: rt_delta_pulse.o /build/reproducible-path/cp2k-8.1/src/emd/rt_delta_pulse.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod qs_mo_types.mod rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod cp_cfm_types.mod cp_control_types.mod kinds.mod cp_gemm_interface.mod cp_dbcsr_cp2k_link.mod cp_fm_struct.mod qs_moments.mod cp_dbcsr_operations.mod cp_cfm_basic_linalg.mod cp_fm_cholesky.mod cp_cfm_diag.mod cp_fm_basic_linalg.mod base_hooks.mod mathconstants.mod commutator_rpnl.mod cp_fm_diag.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagation.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/rt_propagation.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_mo_types.mod rt_propagation_types.mod pw_env_types.mod qs_environment_types.mod md_environment_types.mod cp_control_types.mod force_env_types.mod cp_fm_types.mod qs_energy_types.mod global_types.mod input_section_types.mod qs_ks_types.mod input_constants.mod qs_ks_methods.mod qs_dftb_matrices.mod qs_matrix_pools.mod kinds.mod qs_external_potential.mod rt_propagation_output.mod force_env_methods.mod qs_energy_init.mod cp_external_control.mod efield_utils.mod cp_output_handling.mod rt_propagation_methods.mod rt_hfx_utils.mod rt_propagation_utils.mod bibliography.mod cp_log_handling.mod base_hooks.mod rt_delta_pulse.mod rt_propagator_init.mod machine.mod input_cp2k_restarts.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'rt_propagation.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/rt_propagation.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod cp_fm_pool_types.mod qs_mo_types.mod force_env_types.mod global_types.mod rt_propagation_types.mod cp_fm_types.mod qs_environment_types.mod pw_env_types.mod md_environment_types.mod input_section_types.mod cp_control_types.mod qs_energy_types.mod rt_propagator_init.mod cp_log_handling.mod kinds.mod rt_hfx_utils.mod cp_output_handling.mod qs_dftb_matrices.mod bibliography.mod cp_external_control.mod qs_matrix_pools.mod rt_propagation_methods.mod rt_delta_pulse.mod input_cp2k_restarts.mod force_env_methods.mod qs_ks_methods.mod qs_external_potential.mod rt_propagation_utils.mod machine.mod base_hooks.mod rt_propagation_output.mod efield_utils.mod qs_energy_init.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/rt_propagation.F rt_propagation.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/rt_propagation.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/rt_propagation.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' rt_propagation.F90 /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_public.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_public.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod pint_types.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/pint_public.F pint_public.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_public.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_public.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_public.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_public.F90 /build/reproducible-path/cp2k-8.1/src/motion/pint_public.F:80:3: 80 | FUNCTION pint_cog_pos(pint_env) RESULT(cntrd_r) @@ -47741,32 +47776,34 @@ Warning: 'pint_free_part_bead_x' defined but not used [-Wunused-function] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_public.mod' due to: pint_public.o /build/reproducible-path/cp2k-8.1/src/motion/pint_public.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod pint_types.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_io.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pint_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod cell_types.mod input_constants.mod cp_log_handling.mod pint_public.mod base_hooks.mod cp_output_handling.mod f77_interface.mod pint_transformations.mod machine.mod cp_units.mod kinds.mod particle_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_io.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod particle_list_types.mod pint_types.mod cell_types.mod force_env_types.mod pint_public.mod cp_log_handling.mod kinds.mod f77_interface.mod pint_transformations.mod base_hooks.mod input_constants.mod particle_methods.mod cp_output_handling.mod machine.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/pint_io.F pint_io.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_io.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_io.mod' due to: pint_io.o /build/reproducible-path/cp2k-8.1/src/motion/pint_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pint_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod cell_types.mod input_constants.mod cp_log_handling.mod pint_public.mod base_hooks.mod cp_output_handling.mod f77_interface.mod pint_transformations.mod machine.mod cp_units.mod kinds.mod particle_methods.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_io.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_io.mod' due to: pint_io.o /build/reproducible-path/cp2k-8.1/src/motion/pint_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod particle_list_types.mod pint_types.mod cell_types.mod force_env_types.mod pint_public.mod cp_log_handling.mod kinds.mod f77_interface.mod pint_transformations.mod base_hooks.mod input_constants.mod particle_methods.mod cp_output_handling.mod machine.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_qtb.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_qtb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod pint_types.mod parallel_rng_types.mod input_constants.mod pint_io.mod cp_log_handling.mod mathconstants.mod message_passing.mod base_hooks.mod cp_output_handling.mod cp_files.mod fft_tools.mod kinds.mod fft_plan.mod fft_lib.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_qtb.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_qtb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod input_section_types.mod pint_types.mod message_passing.mod mathconstants.mod cp_log_handling.mod cp_files.mod kinds.mod pint_io.mod input_constants.mod cp_output_handling.mod fft_lib.mod fft_tools.mod fft_plan.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/pint_qtb.F pint_qtb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:16:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_qtb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_qtb.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_pile.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_pile.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod pint_types.mod parallel_rng_types.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_qtb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_qtb.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_pile.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_pile.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod input_section_types.mod pint_types.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/pint_pile.F pint_pile.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:17:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_pile.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_pile.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_piglet.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_piglet.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod pint_types.mod parallel_rng_types.mod input_constants.mod pint_io.mod base_hooks.mod message_passing.mod gle_system_dynamics.mod cp_files.mod cp_units.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_pile.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_pile.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_piglet.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_piglet.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod input_section_types.mod pint_types.mod message_passing.mod cp_files.mod kinds.mod pint_io.mod base_hooks.mod gle_system_dynamics.mod input_constants.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/pint_piglet.F pint_piglet.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:17:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_piglet.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_piglet.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_piglet.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_piglet.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_pile.mod' due to: pint_pile.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_gle.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_gle.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 gle_system_types.mod pint_types.mod base_hooks.mod gle_system_dynamics.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_gle.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_gle.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 gle_system_types.mod pint_types.mod kinds.mod gle_system_dynamics.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/pint_gle.F pint_gle.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:17:09 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_gle.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_gle.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_gle.mod' due to: pint_gle.o /build/reproducible-path/cp2k-8.1/src/motion/pint_gle.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 gle_system_types.mod pint_types.mod base_hooks.mod gle_system_dynamics.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_gle.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_gle.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_gle.mod' due to: pint_gle.o /build/reproducible-path/cp2k-8.1/src/motion/pint_gle.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 gle_system_types.mod pint_types.mod kinds.mod gle_system_dynamics.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_qtb.mod' due to: pint_qtb.o true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_piglet.mod' due to: pint_piglet.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_common.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_common.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod helium_types.mod pint_types.mod input_constants.mod pint_public.mod mathconstants.mod base_hooks.mod splines_methods.mod physcon.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_common.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_common.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 helium_types.mod splines_types.mod pint_types.mod mathconstants.mod pint_public.mod kinds.mod input_constants.mod physcon.mod splines_methods.mod memory_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/helium_common.F helium_common.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:17:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_common.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_common.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_common.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_common.F90 /build/reproducible-path/cp2k-8.1/src/motion/helium_common.F:1468:3: 1468 | FUNCTION helium_bead_rij(helium, ia, ib, ja, jb) RESULT(rij) @@ -47822,43 +47859,41 @@ 354 | DEALLOCATE (used_indices) | ^ Warning: 'used_indices.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_common.mod' due to: helium_common.o /build/reproducible-path/cp2k-8.1/src/motion/helium_common.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod helium_types.mod pint_types.mod input_constants.mod pint_public.mod mathconstants.mod base_hooks.mod splines_methods.mod physcon.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_common.mod' due to: helium_common.o /build/reproducible-path/cp2k-8.1/src/motion/helium_common.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 helium_types.mod splines_types.mod pint_types.mod mathconstants.mod pint_public.mod kinds.mod input_constants.mod physcon.mod splines_methods.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_interactions.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_interactions.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod helium_types.mod pint_types.mod input_constants.mod base_hooks.mod helium_common.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_interactions.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_interactions.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 helium_types.mod pint_types.mod splines_types.mod kinds.mod input_constants.mod physcon.mod helium_common.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/helium_interactions.F helium_interactions.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:17:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_interactions.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_interactions.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_interactions.mod' due to: helium_interactions.o /build/reproducible-path/cp2k-8.1/src/motion/helium_interactions.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 splines_types.mod helium_types.mod pint_types.mod input_constants.mod base_hooks.mod helium_common.mod physcon.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:26 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_interactions.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_interactions.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_interactions.mod' due to: helium_interactions.o /build/reproducible-path/cp2k-8.1/src/motion/helium_interactions.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 helium_types.mod pint_types.mod splines_types.mod kinds.mod input_constants.mod physcon.mod helium_common.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_io.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pint_types.mod cell_types.mod cp_para_types.mod helium_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod kinds.mod cp_output_handling.mod physcon.mod cp_parser_methods.mod message_passing.mod helium_common.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod helium_interactions.mod machine.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_io.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod cp_parser_types.mod helium_types.mod input_section_types.mod pint_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod helium_common.mod message_passing.mod helium_interactions.mod memory_utilities.mod machine.mod base_hooks.mod input_constants.mod cp_parser_methods.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/helium_io.F helium_io.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:17:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_io.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_io.mod' due to: helium_io.o /build/reproducible-path/cp2k-8.1/src/motion/helium_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pint_types.mod cell_types.mod cp_para_types.mod helium_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod kinds.mod cp_output_handling.mod physcon.mod cp_parser_methods.mod message_passing.mod helium_common.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod helium_interactions.mod machine.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_qtb.mod' due to: pint_qtb.o +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_io.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_io.mod' due to: helium_io.o /build/reproducible-path/cp2k-8.1/src/motion/helium_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod cp_parser_types.mod helium_types.mod input_section_types.mod pint_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod helium_common.mod message_passing.mod helium_interactions.mod memory_utilities.mod machine.mod base_hooks.mod input_constants.mod cp_parser_methods.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_worm.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_worm.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 helium_types.mod pint_types.mod input_constants.mod base_hooks.mod mathconstants.mod helium_interactions.mod helium_common.mod kinds.mod helium_io.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_worm.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_worm.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 helium_types.mod pint_types.mod helium_interactions.mod mathconstants.mod kinds.mod input_constants.mod helium_io.mod helium_common.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/helium_worm.F helium_worm.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:17:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_worm.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_worm.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_worm.mod' due to: helium_worm.o /build/reproducible-path/cp2k-8.1/src/motion/helium_worm.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 helium_types.mod pint_types.mod input_constants.mod base_hooks.mod mathconstants.mod helium_interactions.mod helium_common.mod kinds.mod helium_io.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:32 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_worm.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_worm.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_worm.mod' due to: helium_worm.o /build/reproducible-path/cp2k-8.1/src/motion/helium_worm.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 helium_types.mod pint_types.mod helium_interactions.mod mathconstants.mod kinds.mod input_constants.mod helium_io.mod helium_common.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_sampling.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_sampling.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pint_types.mod splines_types.mod global_types.mod helium_types.mod input_constants.mod kinds.mod pint_public.mod cp_external_control.mod cp_output_handling.mod physcon.mod helium_io.mod message_passing.mod helium_common.mod helium_worm.mod cp_log_handling.mod base_hooks.mod helium_interactions.mod machine.mod input_cp2k_restarts.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_sampling.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_sampling.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod helium_types.mod splines_types.mod pint_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod helium_common.mod message_passing.mod helium_interactions.mod cp_external_control.mod pint_public.mod input_cp2k_restarts.mod helium_io.mod helium_worm.mod machine.mod base_hooks.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/helium_sampling.F helium_sampling.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:17:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_sampling.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_sampling.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_sampling.mod' due to: helium_sampling.o /build/reproducible-path/cp2k-8.1/src/motion/helium_sampling.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pint_types.mod splines_types.mod global_types.mod helium_types.mod input_constants.mod kinds.mod pint_public.mod cp_external_control.mod cp_output_handling.mod physcon.mod helium_io.mod message_passing.mod helium_common.mod helium_worm.mod cp_log_handling.mod base_hooks.mod helium_interactions.mod machine.mod input_cp2k_restarts.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_sampling.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_sampling.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_sampling.mod' due to: helium_sampling.o /build/reproducible-path/cp2k-8.1/src/motion/helium_sampling.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod helium_types.mod splines_types.mod pint_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod helium_common.mod message_passing.mod helium_interactions.mod cp_external_control.mod pint_public.mod input_cp2k_restarts.mod helium_io.mod helium_worm.mod machine.mod base_hooks.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pint_types.mod parallel_rng_types.mod cell_types.mod splines_types.mod cp_subsys_types.mod force_env_types.mod particle_list_types.mod atomic_kind_types.mod helium_types.mod input_section_types.mod input_constants.mod mathconstants.mod cp_files.mod kinds.mod pint_public.mod f77_interface.mod cp_output_handling.mod physcon.mod helium_io.mod message_passing.mod helium_sampling.mod helium_common.mod bibliography.mod cp_log_handling.mod base_hooks.mod helium_interactions.mod splines_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'helium_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/helium_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod particle_list_types.mod atomic_kind_types.mod helium_types.mod splines_types.mod input_section_types.mod pint_types.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod cp_output_handling.mod helium_common.mod bibliography.mod message_passing.mod helium_interactions.mod helium_sampling.mod pint_public.mod helium_io.mod cp_files.mod splines_methods.mod base_hooks.mod mathconstants.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/helium_methods.F helium_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:18:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:18:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/helium_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' helium_methods.F90 /build/reproducible-path/cp2k-8.1/src/motion/helium_methods.F:439:16: 439 | IF (expl_pot) THEN | ^ Warning: 'expl_pot' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_methods.mod' due to: helium_methods.o /build/reproducible-path/cp2k-8.1/src/motion/helium_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 pint_types.mod parallel_rng_types.mod cell_types.mod splines_types.mod cp_subsys_types.mod force_env_types.mod particle_list_types.mod atomic_kind_types.mod helium_types.mod input_section_types.mod input_constants.mod mathconstants.mod cp_files.mod kinds.mod pint_public.mod f77_interface.mod cp_output_handling.mod physcon.mod helium_io.mod message_passing.mod helium_sampling.mod helium_common.mod bibliography.mod cp_log_handling.mod base_hooks.mod helium_interactions.mod splines_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'helium_methods.mod' due to: helium_methods.o /build/reproducible-path/cp2k-8.1/src/motion/helium_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod particle_list_types.mod atomic_kind_types.mod helium_types.mod splines_types.mod input_section_types.mod pint_types.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod cp_output_handling.mod helium_common.mod bibliography.mod message_passing.mod helium_interactions.mod helium_sampling.mod pint_public.mod helium_io.mod cp_files.mod splines_methods.mod base_hooks.mod mathconstants.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod pint_types.mod parallel_rng_types.mod cell_types.mod atomic_kind_list_types.mod gle_system_types.mod cp_para_types.mod replica_types.mod particle_types.mod molecule_kind_types.mod cp_subsys_types.mod simpar_types.mod force_env_types.mod particle_list_types.mod distribution_1d_types.mod global_types.mod molecule_list_types.mod atomic_kind_types.mod helium_types.mod input_section_types.mod molecule_types.mod input_constants.mod pint_pile.mod mathconstants.mod pint_transformations.mod kinds.mod pint_public.mod cp_external_control.mod pint_gle.mod f77_interface.mod cp_output_handling.mod pint_piglet.mod helium_io.mod pint_qtb.mod pint_io.mod pint_staging.mod message_passing.mod helium_sampling.mod pint_normalmode.mod gle_system_dynamics.mod bibliography.mod helium_methods.mod mathlib.mod constraint.mod cp_log_handling.mod helium_interactions.mod replica_methods.mod base_hooks.mod constraint_util.mod machine.mod cp_units.mod input_cp2k_restarts.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pint_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/pint_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod gle_system_types.mod cell_types.mod particle_types.mod force_env_types.mod parallel_rng_types.mod molecule_types.mod particle_list_types.mod global_types.mod molecule_kind_list_types.mod atomic_kind_types.mod helium_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod replica_types.mod molecule_list_types.mod simpar_types.mod atomic_kind_list_types.mod pint_types.mod cp_log_handling.mod kinds.mod f77_interface.mod pint_pile.mod pint_gle.mod gle_system_dynamics.mod cp_output_handling.mod pint_qtb.mod bibliography.mod pint_piglet.mod message_passing.mod helium_interactions.mod cp_external_control.mod helium_sampling.mod pint_public.mod input_cp2k_restarts.mod replica_methods.mod helium_io.mod mathlib.mod pint_staging.mod pint_normalmode.mod pint_io.mod constraint_util.mod constraint.mod machine.mod base_hooks.mod helium_methods.mod mathconstants.mod pint_transformations.mod input_constants.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/pint_methods.F pint_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:18:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/pint_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pint_methods.F90 /build/reproducible-path/cp2k-8.1/src/motion/pint_methods.F:692:25: 692 | SUBROUTINE pint_retain(pint_env) @@ -47884,159 +47919,159 @@ 2429 | pint_env%uv(1, j + (i - 1)*3) = vel(j, i)*factor | ^ Warning: 'factor' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_neb.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_neb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod input_cp2k_thermostats.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_neb.F input_cp2k_neb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:18:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_neb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_neb.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_neb.mod' due to: input_cp2k_neb.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_neb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod input_cp2k_thermostats.mod bibliography.mod cp_output_handling.mod cp_units.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'neb_md_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/neb_md_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod neb_types.mod input_section_types.mod particle_types.mod input_constants.mod base_hooks.mod physcon.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'neb_md_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/neb_md_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 neb_types.mod global_types.mod particle_types.mod input_section_types.mod kinds.mod base_hooks.mod input_constants.mod physcon.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/neb_md_utils.F neb_md_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:18:52 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_md_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_md_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_md_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_md_utils.F90 /build/reproducible-path/cp2k-8.1/src/motion/neb_md_utils.F:119:47: 119 | temp = 2.0_dp*akin/REAL(nvar, KIND=dp) | ^ Warning: 'nvar' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'neb_md_utils.mod' due to: neb_md_utils.o /build/reproducible-path/cp2k-8.1/src/motion/neb_md_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod neb_types.mod input_section_types.mod particle_types.mod input_constants.mod base_hooks.mod physcon.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'neb_md_utils.mod' due to: neb_md_utils.o /build/reproducible-path/cp2k-8.1/src/motion/neb_md_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 neb_types.mod global_types.mod particle_types.mod input_section_types.mod kinds.mod base_hooks.mod input_constants.mod physcon.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_lbfgs.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod cp_files.mod machine.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs.F cp_lbfgs.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cp_lbfgs.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_lbfgs.F90 +/build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs.F:1223:62: + + 1223 | tu, wmc, wmp, wmw, zibp + | ^ +Warning: 'tu' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs.F:1308:38: + + 1308 | t(nbreak) = tl/(-neggi) + | ^ +Warning: 'tl' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_lbfgs.mod' due to: cp_lbfgs.o /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod cp_files.mod machine.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_lbfgs_optimizer_gopt.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod force_env_types.mod gopt_f_types.mod gopt_param_types.mod message_passing.mod cp_log_handling.mod gopt_f_methods.mod kinds.mod base_hooks.mod cp_output_handling.mod cp_para_env.mod cp_lbfgs.mod machine.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F cp_lbfgs_optimizer_gopt.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cp_lbfgs_optimizer_gopt.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_lbfgs_optimizer_gopt.F90 +/build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F:302:32: + + 302 | SUBROUTINE cp_opt_gopt_retain(optimizer) + | ^ +Warning: 'cp_opt_gopt_retain' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F:398:29: + + 398 | SUBROUTINE cp_opt_gopt_get(optimizer, para_env, & + | ^ +Warning: 'cp_opt_gopt_get' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_lbfgs_optimizer_gopt.mod' due to: cp_lbfgs_optimizer_gopt.o /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod force_env_types.mod gopt_f_types.mod gopt_param_types.mod message_passing.mod cp_log_handling.mod gopt_f_methods.mod kinds.mod base_hooks.mod cp_output_handling.mod cp_para_env.mod cp_lbfgs.mod machine.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_lbfgs_geo.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_geo.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod global_types.mod gopt_f_types.mod cell_types.mod force_env_types.mod gopt_param_types.mod cp_external_control.mod cp_log_handling.mod gopt_f_methods.mod kinds.mod base_hooks.mod cp_lbfgs_optimizer_gopt.mod input_constants.mod cp_output_handling.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_geo.F cp_lbfgs_geo.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cp_lbfgs_geo.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_lbfgs_geo.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_lbfgs_geo.mod' due to: cp_lbfgs_geo.o /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_geo.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod global_types.mod gopt_f_types.mod cell_types.mod force_env_types.mod gopt_param_types.mod cp_external_control.mod cp_log_handling.mod gopt_f_methods.mod kinds.mod base_hooks.mod cp_lbfgs_optimizer_gopt.mod input_constants.mod cp_output_handling.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'neb_io.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/neb_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cell_types.mod input_enumeration_types.mod neb_types.mod replica_types.mod particle_types.mod force_env_types.mod input_section_types.mod input_cp2k_neb.mod input_constants.mod cp2k_info.mod header.mod cp_files.mod kinds.mod neb_md_utils.mod f77_interface.mod cp_output_handling.mod physcon.mod particle_methods.mod cp_log_handling.mod base_hooks.mod machine.mod cp_units.mod input_cp2k_restarts.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'bfgs_optimizer.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/bfgs_optimizer.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod gopt_f_types.mod cell_types.mod force_env_types.mod particle_list_types.mod global_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod gopt_param_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod message_passing.mod cp_external_control.mod gopt_f_methods.mod constraint_fxd.mod cp_fm_basic_linalg.mod cp_files.mod cp_blacs_env.mod machine.mod base_hooks.mod cp_fm_diag.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/bfgs_optimizer.F bfgs_optimizer.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/bfgs_optimizer.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bfgs_optimizer.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'bfgs_optimizer.mod' due to: bfgs_optimizer.o /build/reproducible-path/cp2k-8.1/src/motion/bfgs_optimizer.F /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod gopt_f_types.mod cell_types.mod force_env_types.mod particle_list_types.mod global_types.mod cp_fm_types.mod atomic_kind_types.mod input_section_types.mod gopt_param_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod cp_gemm_interface.mod cp_output_handling.mod cp_fm_struct.mod message_passing.mod cp_external_control.mod gopt_f_methods.mod constraint_fxd.mod cp_fm_basic_linalg.mod cp_files.mod cp_blacs_env.mod machine.mod base_hooks.mod cp_fm_diag.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'geo_opt.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/geo_opt.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod global_types.mod gopt_f_types.mod force_env_types.mod gopt_param_types.mod cg_optimizer.mod cp_log_handling.mod gopt_f_methods.mod kinds.mod base_hooks.mod cp_lbfgs_geo.mod input_constants.mod cp_output_handling.mod bfgs_optimizer.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/geo_opt.F geo_opt.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/geo_opt.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' geo_opt.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'geo_opt.mod' due to: geo_opt.o /build/reproducible-path/cp2k-8.1/src/motion/geo_opt.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod global_types.mod gopt_f_types.mod force_env_types.mod gopt_param_types.mod cg_optimizer.mod cp_log_handling.mod gopt_f_methods.mod kinds.mod base_hooks.mod cp_lbfgs_geo.mod input_constants.mod cp_output_handling.mod bfgs_optimizer.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_neb.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_neb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_cp2k_thermostats.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_neb.F input_cp2k_neb.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:29 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_neb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_neb.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_neb.mod' due to: input_cp2k_neb.o /build/reproducible-path/cp2k-8.1/src/input_cp2k_neb.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_cp2k_thermostats.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'neb_io.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/neb_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod input_enumeration_types.mod force_env_types.mod input_keyword_types.mod neb_types.mod input_section_types.mod replica_types.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod cp_output_handling.mod neb_md_utils.mod input_cp2k_restarts.mod cp2k_info.mod cp_files.mod particle_methods.mod machine.mod base_hooks.mod header.mod input_constants.mod input_cp2k_neb.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/neb_io.F neb_io.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:18:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_io.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_io.F90 /build/reproducible-path/cp2k-8.1/src/motion/neb_io.F:426:55: 426 | logger%iter_info%project_name = replica_proj_name | 1 Warning: CHARACTER expression will be truncated in assignment (80/1024) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'neb_io.mod' due to: neb_io.o /build/reproducible-path/cp2k-8.1/src/motion/neb_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cell_types.mod input_enumeration_types.mod neb_types.mod replica_types.mod particle_types.mod force_env_types.mod input_section_types.mod input_cp2k_neb.mod input_constants.mod cp2k_info.mod header.mod cp_files.mod kinds.mod neb_md_utils.mod f77_interface.mod cp_output_handling.mod physcon.mod particle_methods.mod cp_log_handling.mod base_hooks.mod machine.mod cp_units.mod input_cp2k_restarts.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'neb_io.mod' due to: neb_io.o /build/reproducible-path/cp2k-8.1/src/motion/neb_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod cell_types.mod input_enumeration_types.mod force_env_types.mod input_keyword_types.mod neb_types.mod input_section_types.mod replica_types.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod cp_output_handling.mod neb_md_utils.mod input_cp2k_restarts.mod cp2k_info.mod cp_files.mod particle_methods.mod machine.mod base_hooks.mod header.mod input_constants.mod input_cp2k_neb.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mdctrl_types.o' due to: /build/reproducible-path/cp2k-8.1/src/mdctrl_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mdctrl_types.o' due to: /build/reproducible-path/cp2k-8.1/src/mdctrl_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mdctrl_types.F mdctrl_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:19:03 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mdctrl_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mdctrl_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mdctrl_types.mod' due to: mdctrl_types.o /build/reproducible-path/cp2k-8.1/src/mdctrl_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'thermal_region_utils.mod' due to: thermal_region_utils.o +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:32 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mdctrl_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mdctrl_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mdctrl_types.mod' due to: mdctrl_types.o /build/reproducible-path/cp2k-8.1/src/mdctrl_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'statistical_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/statistical_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod base_hooks.mod cp_log_handling.mod util.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/statistical_methods.F statistical_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:19:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"statistical_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' statistical_methods.F90 -/build/reproducible-path/cp2k-8.1/src/statistical_methods.F:440:19: - - 440 | SUBROUTINE tests(xdata, globenv) - | ^ -Warning: 'tests' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'statistical_methods.mod' due to: statistical_methods.o /build/reproducible-path/cp2k-8.1/src/statistical_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod base_hooks.mod cp_log_handling.mod util.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'wiener_process.mod' due to: wiener_process.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'free_energy_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/free_energy_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 free_energy_types.mod input_section_types.mod cp_subsys_types.mod md_environment_types.mod simpar_types.mod force_env_types.mod input_constants.mod string_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod fparser.mod colvar_methods.mod statistical_methods.mod cp_output_handling.mod kinds.mod memory_utilities.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/free_energy_methods.F free_energy_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:19:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/free_energy_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' free_energy_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'free_energy_methods.mod' due to: free_energy_methods.o /build/reproducible-path/cp2k-8.1/src/motion/free_energy_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 free_energy_types.mod input_section_types.mod cp_subsys_types.mod md_environment_types.mod simpar_types.mod force_env_types.mod input_constants.mod string_utilities.mod mathlib.mod cp_log_handling.mod base_hooks.mod fparser.mod colvar_methods.mod statistical_methods.mod cp_output_handling.mod kinds.mod memory_utilities.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'thermal_region_utils.mod' due to: thermal_region_utils.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'barostat_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/barostat_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 barostat_types.mod extended_system_types.mod simpar_types.mod cell_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod machine.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'barostat_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/thermostat/barostat_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod barostat_types.mod simpar_types.mod cell_types.mod cp_log_handling.mod kinds.mod input_constants.mod physcon.mod cp_output_handling.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/thermostat/barostat_utils.F barostat_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:19:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/barostat_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' barostat_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'barostat_utils.mod' due to: barostat_utils.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/barostat_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 barostat_types.mod extended_system_types.mod simpar_types.mod cell_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod machine.mod physcon.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/thermostat/barostat_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/thermostat/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' barostat_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'barostat_utils.mod' due to: barostat_utils.o /build/reproducible-path/cp2k-8.1/src/motion/thermostat/barostat_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 extended_system_types.mod barostat_types.mod simpar_types.mod cell_types.mod cp_log_handling.mod kinds.mod input_constants.mod physcon.mod cp_output_handling.mod machine.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_conserved_quantities.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_conserved_quantities.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod atomic_kind_list_types.mod qmmmx_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod md_environment_types.mod particle_types.mod cp_subsys_types.mod simpar_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod md_ener_types.mod qmmm_types.mod input_constants.mod mathconstants.mod kinds.mod thermostat_utils.mod physcon.mod barostat_utils.mod message_passing.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_conserved_quantities.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_conserved_quantities.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod force_env_types.mod particle_list_types.mod qmmmx_types.mod thermostat_types.mod md_ener_types.mod atomic_kind_types.mod qmmm_types.mod extended_system_types.mod md_environment_types.mod distribution_1d_types.mod input_section_types.mod shell_potential_types.mod simpar_types.mod atomic_kind_list_types.mod kinds.mod physcon.mod message_passing.mod base_hooks.mod mathconstants.mod barostat_utils.mod input_constants.mod thermostat_utils.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/md_conserved_quantities.F md_conserved_quantities.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:19:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_conserved_quantities.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_conserved_quantities.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_conserved_quantities.mod' due to: md_conserved_quantities.o /build/reproducible-path/cp2k-8.1/src/motion/md_conserved_quantities.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 shell_potential_types.mod cell_types.mod atomic_kind_list_types.mod qmmmx_types.mod cp_para_types.mod extended_system_types.mod thermostat_types.mod md_environment_types.mod particle_types.mod cp_subsys_types.mod simpar_types.mod particle_list_types.mod force_env_types.mod distribution_1d_types.mod atomic_kind_types.mod input_section_types.mod qmmm_types_low.mod md_ener_types.mod qmmm_types.mod input_constants.mod mathconstants.mod kinds.mod thermostat_utils.mod physcon.mod barostat_utils.mod message_passing.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_conserved_quantities.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_conserved_quantities.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_conserved_quantities.mod' due to: md_conserved_quantities.o /build/reproducible-path/cp2k-8.1/src/motion/md_conserved_quantities.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod qmmm_types_low.mod particle_types.mod cell_types.mod force_env_types.mod particle_list_types.mod qmmmx_types.mod thermostat_types.mod md_ener_types.mod atomic_kind_types.mod qmmm_types.mod extended_system_types.mod md_environment_types.mod distribution_1d_types.mod input_section_types.mod shell_potential_types.mod simpar_types.mod atomic_kind_list_types.mod kinds.mod physcon.mod message_passing.mod base_hooks.mod mathconstants.mod barostat_utils.mod input_constants.mod thermostat_utils.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_energies.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_energies.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cell_types.mod atomic_kind_list_types.mod input_enumeration_types.mod cp_para_types.mod virial_types.mod thermostat_types.mod md_environment_types.mod reftraj_types.mod averages_types.mod thermal_region_types.mod barostat_types.mod cp_subsys_types.mod simpar_types.mod particle_list_types.mod force_env_types.mod atomic_kind_types.mod input_section_types.mod md_ener_types.mod qmmm_types.mod input_constants.mod thermal_region_utils.mod kinds.mod motion_utils.mod thermostat_utils.mod md_conserved_quantities.mod cp_output_handling.mod physcon.mod input_cp2k_md.mod barostat_utils.mod qs_linres_polar_utils.mod particle_methods.mod cp_log_handling.mod base_hooks.mod machine.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_energies.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_energies.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod averages_types.mod cell_types.mod input_enumeration_types.mod force_env_types.mod thermal_region_types.mod barostat_types.mod particle_list_types.mod reftraj_types.mod thermostat_types.mod md_ener_types.mod input_keyword_types.mod atomic_kind_types.mod qmmm_types.mod md_environment_types.mod input_section_types.mod virial_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod thermal_region_utils.mod input_cp2k_md.mod motion_utils.mod particle_methods.mod md_conserved_quantities.mod machine.mod base_hooks.mod qs_linres_polar_utils.mod barostat_utils.mod input_constants.mod thermostat_utils.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/md_energies.F md_energies.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:19:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_energies.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_energies.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_energies.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_energies.F90 /build/reproducible-path/cp2k-8.1/src/motion/md_energies.F:362:46: 362 | (simpar%v0 - cell%deth) | ^ Warning: 'pv_xx_nc' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_energies.mod' due to: md_energies.o /build/reproducible-path/cp2k-8.1/src/motion/md_energies.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cell_types.mod atomic_kind_list_types.mod input_enumeration_types.mod cp_para_types.mod virial_types.mod thermostat_types.mod md_environment_types.mod reftraj_types.mod averages_types.mod thermal_region_types.mod barostat_types.mod cp_subsys_types.mod simpar_types.mod particle_list_types.mod force_env_types.mod atomic_kind_types.mod input_section_types.mod md_ener_types.mod qmmm_types.mod input_constants.mod thermal_region_utils.mod kinds.mod motion_utils.mod thermostat_utils.mod md_conserved_quantities.mod cp_output_handling.mod physcon.mod input_cp2k_md.mod barostat_utils.mod qs_linres_polar_utils.mod particle_methods.mod cp_log_handling.mod base_hooks.mod machine.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagation.mod' due to: rt_propagation.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'simpar_methods.mod' due to: simpar_methods.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'velocity_verlet_control.mod' due to: velocity_verlet_control.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'wiener_process.mod' due to: wiener_process.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_callback.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/glbopt_callback.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mdctrl_types.mod cp_subsys_types.mod md_ener_types.mod force_env_types.mod md_environment_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/glbopt_callback.F glbopt_callback.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:19:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/glbopt_callback.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_callback.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_callback.mod' due to: glbopt_callback.o /build/reproducible-path/cp2k-8.1/src/motion/glbopt_callback.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mdctrl_types.mod cp_subsys_types.mod md_ener_types.mod force_env_types.mod md_environment_types.mod base_hooks.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mdctrl_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mdctrl_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 md_environment_types.mod mdctrl_types.mod base_hooks.mod glbopt_callback.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mdctrl_methods.F mdctrl_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:19:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mdctrl_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mdctrl_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mdctrl_methods.mod' due to: mdctrl_methods.o /build/reproducible-path/cp2k-8.1/src/motion/mdctrl_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 md_environment_types.mod mdctrl_types.mod base_hooks.mod glbopt_callback.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_energies.mod' due to: md_energies.o /build/reproducible-path/cp2k-8.1/src/motion/md_energies.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod averages_types.mod cell_types.mod input_enumeration_types.mod force_env_types.mod thermal_region_types.mod barostat_types.mod particle_list_types.mod reftraj_types.mod thermostat_types.mod md_ener_types.mod input_keyword_types.mod atomic_kind_types.mod qmmm_types.mod md_environment_types.mod input_section_types.mod virial_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod thermal_region_utils.mod input_cp2k_md.mod motion_utils.mod particle_methods.mod md_conserved_quantities.mod machine.mod base_hooks.mod qs_linres_polar_utils.mod barostat_utils.mod input_constants.mod thermostat_utils.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_util.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod md_environment_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod md_energies.mod cp_files.mod kinds.mod input_cp2k_restarts.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_util.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_util.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod md_environment_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod md_energies.mod cp_files.mod kinds.mod cp_output_handling.mod input_cp2k_restarts.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/md_util.F md_util.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:19:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_util.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_util.mod' due to: md_util.o /build/reproducible-path/cp2k-8.1/src/motion/md_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod md_environment_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod md_energies.mod cp_files.mod kinds.mod input_cp2k_restarts.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:40 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_util.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_util.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_util.mod' due to: md_util.o /build/reproducible-path/cp2k-8.1/src/motion/md_util.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod md_environment_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod md_energies.mod cp_files.mod kinds.mod cp_output_handling.mod input_cp2k_restarts.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'rt_propagation.mod' due to: rt_propagation.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_vel_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_vel_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod molecule_kind_list_types.mod shell_potential_types.mod parallel_rng_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod extended_system_types.mod md_environment_types.mod particle_types.mod thermal_region_types.mod molecule_kind_types.mod cp_subsys_types.mod simpar_types.mod force_env_types.mod particle_list_types.mod global_types.mod atomic_kind_types.mod input_section_types.mod md_ener_types.mod input_constants.mod mathconstants.mod kinds.mod input_restart_force_eval.mod force_env_methods.mod cp_output_handling.mod physcon.mod cp_linked_list_input.mod shell_opt.mod bibliography.mod force_env_utils.mod md_util.mod input_cp2k_binary_restarts.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_vel_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_vel_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod cell_types.mod force_env_types.mod thermal_region_types.mod parallel_rng_types.mod particle_list_types.mod global_types.mod md_ener_types.mod molecule_kind_list_types.mod atomic_kind_types.mod extended_system_types.mod input_val_types.mod md_environment_types.mod input_section_types.mod molecule_kind_types.mod shell_potential_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod bibliography.mod md_util.mod force_env_methods.mod mathlib.mod force_env_utils.mod input_restart_force_eval.mod shell_opt.mod base_hooks.mod mathconstants.mod cp_linked_list_input.mod input_constants.mod input_cp2k_binary_restarts.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/md_vel_utils.F md_vel_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:19:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_vel_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_vel_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:41 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_vel_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_vel_utils.F90 /build/reproducible-path/cp2k-8.1/src/motion/md_vel_utils.F:706:24: 706 | rescale_regions, shellvel_explicit, shellvel_read | ^ Warning: 'rescale_regions' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_vel_utils.mod' due to: md_vel_utils.o /build/reproducible-path/cp2k-8.1/src/motion/md_vel_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod molecule_kind_list_types.mod shell_potential_types.mod parallel_rng_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod extended_system_types.mod md_environment_types.mod particle_types.mod thermal_region_types.mod molecule_kind_types.mod cp_subsys_types.mod simpar_types.mod force_env_types.mod particle_list_types.mod global_types.mod atomic_kind_types.mod input_section_types.mod md_ener_types.mod input_constants.mod mathconstants.mod kinds.mod input_restart_force_eval.mod force_env_methods.mod cp_output_handling.mod physcon.mod cp_linked_list_input.mod shell_opt.mod bibliography.mod force_env_utils.mod md_util.mod input_cp2k_binary_restarts.mod mathlib.mod cp_log_handling.mod base_hooks.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_vel_utils.mod' due to: md_vel_utils.o /build/reproducible-path/cp2k-8.1/src/motion/md_vel_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod cell_types.mod force_env_types.mod thermal_region_types.mod parallel_rng_types.mod particle_list_types.mod global_types.mod md_ener_types.mod molecule_kind_list_types.mod atomic_kind_types.mod extended_system_types.mod input_val_types.mod md_environment_types.mod input_section_types.mod molecule_kind_types.mod shell_potential_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod bibliography.mod md_util.mod force_env_methods.mod mathlib.mod force_env_utils.mod input_restart_force_eval.mod shell_opt.mod base_hooks.mod mathconstants.mod cp_linked_list_input.mod input_constants.mod input_cp2k_binary_restarts.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_run.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_run.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mdctrl_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod thermostat_types.mod virial_types.mod md_environment_types.mod reftraj_types.mod averages_types.mod thermal_region_types.mod barostat_types.mod metadynamics_types.mod cp_subsys_types.mod simpar_types.mod particle_list_types.mod force_env_types.mod free_energy_types.mod distribution_1d_types.mod global_types.mod input_section_types.mod md_ener_types.mod input_constants.mod thermal_region_utils.mod metadynamics.mod free_energy_methods.mod md_energies.mod input_cp2k_check.mod kinds.mod rt_propagation.mod force_env_methods.mod simpar_methods.mod cp_external_control.mod qs_environment_methods.mod virial_methods.mod cp_output_handling.mod velocity_verlet_control.mod thermostat_methods.mod wiener_process.mod mdctrl_methods.mod md_util.mod cp_log_handling.mod base_hooks.mod md_vel_utils.mod reftraj_util.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/md_run.F md_run.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:19:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_run.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_run.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_run.mod' due to: md_run.o /build/reproducible-path/cp2k-8.1/src/motion/md_run.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mdctrl_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod thermostat_types.mod virial_types.mod md_environment_types.mod reftraj_types.mod averages_types.mod thermal_region_types.mod barostat_types.mod metadynamics_types.mod cp_subsys_types.mod simpar_types.mod particle_list_types.mod force_env_types.mod free_energy_types.mod distribution_1d_types.mod global_types.mod input_section_types.mod md_ener_types.mod input_constants.mod thermal_region_utils.mod metadynamics.mod free_energy_methods.mod md_energies.mod input_cp2k_check.mod kinds.mod rt_propagation.mod force_env_methods.mod simpar_methods.mod cp_external_control.mod qs_environment_methods.mod virial_methods.mod cp_output_handling.mod velocity_verlet_control.mod thermostat_methods.mod wiener_process.mod mdctrl_methods.mod md_util.mod cp_log_handling.mod base_hooks.mod md_vel_utils.mod reftraj_util.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_callback.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/glbopt_callback.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod md_environment_types.mod md_ener_types.mod force_env_types.mod mdctrl_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/glbopt_callback.F glbopt_callback.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:47 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/glbopt_callback.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_callback.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_callback.mod' due to: glbopt_callback.o /build/reproducible-path/cp2k-8.1/src/motion/glbopt_callback.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod md_environment_types.mod md_ener_types.mod force_env_types.mod mdctrl_types.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'bfgs_optimizer.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/bfgs_optimizer.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 gopt_param_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod gopt_f_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod cp_fm_types.mod global_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod cp_gemm_interface.mod cp_fm_diag.mod gopt_f_methods.mod cp_fm_struct.mod cp_blacs_env.mod cp_files.mod constraint_fxd.mod kinds.mod cp_external_control.mod cp_output_handling.mod cp_fm_basic_linalg.mod message_passing.mod cp_log_handling.mod base_hooks.mod machine.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/bfgs_optimizer.F bfgs_optimizer.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:20:10 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/bfgs_optimizer.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bfgs_optimizer.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'bfgs_optimizer.mod' due to: bfgs_optimizer.o /build/reproducible-path/cp2k-8.1/src/motion/bfgs_optimizer.F /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 gopt_param_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod gopt_f_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod cp_fm_types.mod global_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod cp_gemm_interface.mod cp_fm_diag.mod gopt_f_methods.mod cp_fm_struct.mod cp_blacs_env.mod cp_files.mod constraint_fxd.mod kinds.mod cp_external_control.mod cp_output_handling.mod cp_fm_basic_linalg.mod message_passing.mod cp_log_handling.mod base_hooks.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mdctrl_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mdctrl_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mdctrl_types.mod md_environment_types.mod glbopt_callback.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mdctrl_methods.F mdctrl_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mdctrl_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mdctrl_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mdctrl_methods.mod' due to: mdctrl_methods.o /build/reproducible-path/cp2k-8.1/src/motion/mdctrl_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mdctrl_types.mod md_environment_types.mod glbopt_callback.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_lbfgs.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod bibliography.mod cp_files.mod machine.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs.F cp_lbfgs.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:20:26 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cp_lbfgs.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_lbfgs.F90 -/build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs.F:1223:62: - - 1223 | tu, wmc, wmp, wmw, zibp - | ^ -Warning: 'tu' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs.F:1308:38: - - 1308 | t(nbreak) = tl/(-neggi) - | ^ -Warning: 'tl' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_lbfgs.mod' due to: cp_lbfgs.o /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod bibliography.mod cp_files.mod machine.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'simpar_methods.mod' due to: simpar_methods.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_lbfgs_optimizer_gopt.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod gopt_param_types.mod gopt_f_types.mod force_env_types.mod machine.mod cp_lbfgs.mod cp_log_handling.mod message_passing.mod base_hooks.mod gopt_f_methods.mod cp_output_handling.mod cp_para_env.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F cp_lbfgs_optimizer_gopt.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:20:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cp_lbfgs_optimizer_gopt.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_lbfgs_optimizer_gopt.F90 -/build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F:302:32: - - 302 | SUBROUTINE cp_opt_gopt_retain(optimizer) - | ^ -Warning: 'cp_opt_gopt_retain' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F:398:29: +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'statistical_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/statistical_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod util.mod cp_log_handling.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/statistical_methods.F statistical_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"statistical_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' statistical_methods.F90 +/build/reproducible-path/cp2k-8.1/src/statistical_methods.F:440:19: - 398 | SUBROUTINE cp_opt_gopt_get(optimizer, para_env, & - | ^ -Warning: 'cp_opt_gopt_get' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_lbfgs_optimizer_gopt.mod' due to: cp_lbfgs_optimizer_gopt.o /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_optimizer_gopt.F /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.f90 /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod gopt_param_types.mod gopt_f_types.mod force_env_types.mod machine.mod cp_lbfgs.mod cp_log_handling.mod message_passing.mod base_hooks.mod gopt_f_methods.mod cp_output_handling.mod cp_para_env.mod kinds.mod + 440 | SUBROUTINE tests(xdata, globenv) + | ^ +Warning: 'tests' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'statistical_methods.mod' due to: statistical_methods.o /build/reproducible-path/cp2k-8.1/src/statistical_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod util.mod cp_log_handling.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp_lbfgs_geo.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_geo.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod input_section_types.mod gopt_param_types.mod gopt_f_types.mod force_env_types.mod cell_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_external_control.mod cp_output_handling.mod gopt_f_methods.mod cp_lbfgs_optimizer_gopt.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_geo.F cp_lbfgs_geo.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:20:51 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cp_lbfgs_geo.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp_lbfgs_geo.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp_lbfgs_geo.mod' due to: cp_lbfgs_geo.o /build/reproducible-path/cp2k-8.1/src/motion/cp_lbfgs_geo.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod input_section_types.mod gopt_param_types.mod gopt_f_types.mod force_env_types.mod cell_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_external_control.mod cp_output_handling.mod gopt_f_methods.mod cp_lbfgs_optimizer_gopt.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'free_energy_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/free_energy_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod md_environment_types.mod simpar_types.mod free_energy_types.mod force_env_types.mod mathlib.mod cp_log_handling.mod kinds.mod statistical_methods.mod fparser.mod input_constants.mod cp_output_handling.mod colvar_methods.mod string_utilities.mod memory_utilities.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/free_energy_methods.F free_energy_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:50 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/free_energy_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' free_energy_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'free_energy_methods.mod' due to: free_energy_methods.o /build/reproducible-path/cp2k-8.1/src/motion/free_energy_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod md_environment_types.mod simpar_types.mod free_energy_types.mod force_env_types.mod mathlib.mod cp_log_handling.mod kinds.mod statistical_methods.mod fparser.mod input_constants.mod cp_output_handling.mod colvar_methods.mod string_utilities.mod memory_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'geo_opt.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/geo_opt.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod input_section_types.mod gopt_param_types.mod gopt_f_types.mod force_env_types.mod cg_optimizer.mod input_constants.mod cp_log_handling.mod base_hooks.mod bfgs_optimizer.mod gopt_f_methods.mod cp_output_handling.mod cp_lbfgs_geo.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/geo_opt.F geo_opt.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:20:58 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/geo_opt.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' geo_opt.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'geo_opt.mod' due to: geo_opt.o /build/reproducible-path/cp2k-8.1/src/motion/geo_opt.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod input_section_types.mod gopt_param_types.mod gopt_f_types.mod force_env_types.mod cg_optimizer.mod input_constants.mod cp_log_handling.mod base_hooks.mod bfgs_optimizer.mod gopt_f_methods.mod cp_output_handling.mod cp_lbfgs_geo.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'velocity_verlet_control.mod' due to: velocity_verlet_control.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'md_run.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/md_run.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod averages_types.mod cell_types.mod force_env_types.mod thermal_region_types.mod mdctrl_types.mod barostat_types.mod particle_list_types.mod global_types.mod reftraj_types.mod thermostat_types.mod md_ener_types.mod metadynamics_types.mod md_environment_types.mod free_energy_types.mod distribution_1d_types.mod input_section_types.mod virial_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod wiener_process.mod thermal_region_utils.mod virial_methods.mod md_util.mod cp_external_control.mod rt_propagation.mod md_vel_utils.mod force_env_methods.mod reftraj_util.mod mdctrl_methods.mod thermostat_methods.mod machine.mod simpar_methods.mod base_hooks.mod qs_environment_methods.mod input_cp2k_check.mod md_energies.mod input_constants.mod metadynamics.mod free_energy_methods.mod velocity_verlet_control.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/md_run.F md_run.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/md_run.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' md_run.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'md_run.mod' due to: md_run.o /build/reproducible-path/cp2k-8.1/src/motion/md_run.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod averages_types.mod cell_types.mod force_env_types.mod thermal_region_types.mod mdctrl_types.mod barostat_types.mod particle_list_types.mod global_types.mod reftraj_types.mod thermostat_types.mod md_ener_types.mod metadynamics_types.mod md_environment_types.mod free_energy_types.mod distribution_1d_types.mod input_section_types.mod virial_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod wiener_process.mod thermal_region_utils.mod virial_methods.mod md_util.mod cp_external_control.mod rt_propagation.mod md_vel_utils.mod force_env_methods.mod reftraj_util.mod mdctrl_methods.mod thermostat_methods.mod machine.mod simpar_methods.mod base_hooks.mod qs_environment_methods.mod input_cp2k_check.mod md_energies.mod input_constants.mod metadynamics.mod free_energy_methods.mod velocity_verlet_control.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'neb_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/neb_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 neb_types.mod cp_para_types.mod replica_types.mod particle_types.mod force_env_types.mod global_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod input_cp2k_check.mod kinds.mod neb_io.mod force_env_methods.mod neb_md_utils.mod f77_interface.mod cp_output_handling.mod physcon.mod cp_parser_methods.mod md_run.mod bibliography.mod mathlib.mod cp_log_handling.mod geo_opt.mod replica_methods.mod base_hooks.mod rmsd.mod colvar_utils.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'neb_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/neb_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod cp_parser_types.mod force_env_types.mod global_types.mod neb_types.mod input_section_types.mod replica_types.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod cp_output_handling.mod neb_md_utils.mod bibliography.mod replica_methods.mod force_env_methods.mod geo_opt.mod rmsd.mod mathlib.mod neb_io.mod colvar_utils.mod base_hooks.mod md_run.mod input_cp2k_check.mod input_constants.mod cp_parser_methods.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/neb_utils.F neb_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:21:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:19:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_utils.F90 /build/reproducible-path/cp2k-8.1/src/motion/neb_utils.F:482:64: 482 | forces%wrk(:, SIZE(forces%wrk, 2)) = tmp_b ! Image B @@ -48049,28 +48084,28 @@ Warning: 'tmp_a.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'neb_utils.mod' due to: neb_utils.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'neb_opt_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/neb_opt_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 neb_types.mod input_section_types.mod replica_types.mod particle_types.mod neb_utils.mod cp_log_handling.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'neb_opt_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/neb_opt_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 replica_types.mod neb_types.mod particle_types.mod input_section_types.mod cp_log_handling.mod kinds.mod neb_utils.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/neb_opt_utils.F neb_opt_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:21:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_opt_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_opt_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_opt_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_opt_utils.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'neb_opt_utils.mod' due to: neb_opt_utils.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'neb_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/neb_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 neb_types.mod cp_para_types.mod replica_types.mod particle_types.mod cp_subsys_types.mod force_env_types.mod global_types.mod input_section_types.mod neb_utils.mod input_constants.mod neb_opt_utils.mod header.mod kinds.mod neb_io.mod cp_external_control.mod neb_md_utils.mod f77_interface.mod cp_output_handling.mod physcon.mod cp_log_handling.mod replica_methods.mod base_hooks.mod colvar_utils.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'neb_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/neb_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod particle_types.mod force_env_types.mod global_types.mod neb_types.mod input_section_types.mod replica_types.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod cp_output_handling.mod neb_md_utils.mod cp_external_control.mod replica_methods.mod neb_opt_utils.mod neb_io.mod colvar_utils.mod base_hooks.mod header.mod input_constants.mod neb_utils.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/neb_methods.F neb_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:21:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_vib.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/input_cp2k_vib.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod cp_output_handling.mod cp_units.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/neb_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' neb_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_vib.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/input_cp2k_vib.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod base_hooks.mod input_constants.mod cp_output_handling.mod string_utilities.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/input_cp2k_vib.F input_cp2k_vib.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:21:49 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/input_cp2k_vib.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_vib.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dimer_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/dimer_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_subsys_types.mod gopt_f_types.mod force_env_types.mod dimer_types.mod particle_list_types.mod input_constants.mod motion_utils.mod cp_log_handling.mod force_env_methods.mod geo_opt.mod base_hooks.mod dimer_utils.mod bibliography.mod cp_output_handling.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/input_cp2k_vib.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_vib.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'dimer_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/dimer_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod particle_list_types.mod gopt_f_types.mod dimer_types.mod force_env_types.mod dimer_utils.mod cp_log_handling.mod kinds.mod input_constants.mod cp_output_handling.mod force_env_methods.mod motion_utils.mod geo_opt.mod bibliography.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/dimer_methods.F dimer_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:21:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/dimer_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dimer_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dimer_methods.mod' due to: dimer_methods.o /build/reproducible-path/cp2k-8.1/src/motion/dimer_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod cp_subsys_types.mod gopt_f_types.mod force_env_types.mod dimer_types.mod particle_list_types.mod input_constants.mod motion_utils.mod cp_log_handling.mod force_env_methods.mod geo_opt.mod base_hooks.mod dimer_utils.mod bibliography.mod cp_output_handling.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/dimer_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' dimer_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'dimer_methods.mod' due to: dimer_methods.o /build/reproducible-path/cp2k-8.1/src/motion/dimer_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod input_section_types.mod particle_list_types.mod gopt_f_types.mod dimer_types.mod force_env_types.mod dimer_utils.mod cp_log_handling.mod kinds.mod input_constants.mod cp_output_handling.mod force_env_methods.mod motion_utils.mod geo_opt.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gopt_f77_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod virial_types.mod gopt_f_types.mod averages_types.mod cp_subsys_types.mod force_env_types.mod particle_list_types.mod input_section_types.mod input_constants.mod cell_methods.mod dimer_methods.mod gopt_f_methods.mod cell_opt_utils.mod kinds.mod force_env_methods.mod virial_methods.mod message_passing.mod md_run.mod bibliography.mod particle_methods.mod cp_log_handling.mod geo_opt.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'gopt_f77_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod averages_types.mod gopt_f_types.mod cell_types.mod force_env_types.mod particle_list_types.mod input_section_types.mod virial_types.mod cp_log_handling.mod cell_opt_utils.mod kinds.mod bibliography.mod virial_methods.mod message_passing.mod dimer_methods.mod gopt_f_methods.mod cell_methods.mod force_env_methods.mod geo_opt.mod particle_methods.mod base_hooks.mod md_run.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/gopt_f77_methods.F gopt_f77_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:21:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/gopt_f77_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gopt_f77_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cell_opt.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cell_opt.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod input_section_types.mod gopt_param_types.mod gopt_f_types.mod force_env_types.mod cg_optimizer.mod input_constants.mod cp_log_handling.mod base_hooks.mod bfgs_optimizer.mod gopt_f_methods.mod cp_output_handling.mod cp_lbfgs_geo.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/gopt_f77_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' gopt_f77_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cell_opt.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/cell_opt.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod global_types.mod gopt_f_types.mod force_env_types.mod gopt_param_types.mod cg_optimizer.mod cp_log_handling.mod gopt_f_methods.mod kinds.mod base_hooks.mod cp_lbfgs_geo.mod input_constants.mod cp_output_handling.mod bfgs_optimizer.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/cell_opt.F cell_opt.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:22:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cell_opt.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_opt.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/cell_opt.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cell_opt.F90 /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a' due to: wiener_process.o vibrational_analysis.o velocity_verlet_control.o thermal_region_utils.o thermal_region_types.o simpar_methods.o shell_opt.o rt_propagation.o reftraj_util.o reftraj_types.o pint_types.o pint_transformations.o pint_staging.o pint_qtb.o pint_public.o pint_pile.o pint_piglet.o pint_normalmode.o pint_methods.o pint_io.o pint_gle.o neb_utils.o neb_types.o neb_opt_utils.o neb_methods.o neb_md_utils.o neb_io.o mdctrl_methods.o md_vel_utils.o md_util.o md_run.o md_environment_types.o md_energies.o md_ener_types.o md_conserved_quantities.o integrator_utils.o integrator.o input_cp2k_vib.o input_cp2k_restarts.o input_cp2k_md.o helium_worm.o helium_types.o helium_sampling.o helium_methods.o helium_io.o helium_interactions.o helium_common.o gopt_param_types.o gopt_f_types.o gopt_f_methods.o gopt_f77_methods.o glbopt_callback.o geo_opt.o free_energy_methods.o dimer_utils.o dimer_types.o dimer_methods.o cp_lbfgs_optimizer_gopt.o cp_lbfgs_geo.o cp_lbfgs.o cg_utils.o cg_optimizer.o cell_opt_utils.o cell_opt_types.o cell_opt.o bfgs_optimizer.o averages_types.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a" Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a @@ -48086,102 +48121,102 @@ Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a rt_propagator_init.o rt_propagation_utils.o rt_propagation_output.o rt_propagation_methods.o rt_make_propagators.o rt_hfx_utils.o rt_delta_pulse.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'shg_integrals_test.o' due to: /build/reproducible-path/cp2k-8.1/src/shg_integrals_test.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod basis_set_types.mod input_keyword_types.mod input_section_types.mod cp_log_handling.mod base_hooks.mod generic_os_integrals.mod generic_shg_integrals_init.mod constants_operator.mod generic_shg_integrals.mod input_cp2k_subsys.mod orbital_transformation_matrices.mod orbital_pointers.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'shg_integrals_test.o' due to: /build/reproducible-path/cp2k-8.1/src/shg_integrals_test.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 basis_set_types.mod input_val_types.mod input_section_types.mod input_keyword_types.mod cp_log_handling.mod kinds.mod orbital_pointers.mod generic_shg_integrals_init.mod orbital_transformation_matrices.mod input_cp2k_subsys.mod generic_os_integrals.mod generic_shg_integrals.mod constants_operator.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/shg_integrals_test.F shg_integrals_test.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:22:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_integrals_test.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' shg_integrals_test.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_debug.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_debug.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod base_hooks.mod semi_empirical_int_arrays.mod semi_empirical_int_utils.mod semi_empirical_int_num.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"shg_integrals_test.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' shg_integrals_test.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'semi_empirical_int_debug.o' due to: /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_debug.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 semi_empirical_types.mod kinds.mod semi_empirical_int_arrays.mod semi_empirical_int_utils.mod semi_empirical_int_num.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/semi_empirical_int_debug.F semi_empirical_int_debug.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:22:20 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_debug.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_debug.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_control_types.mod cp_para_types.mod qs_p_env_types.mod qs_environment_types.mod cp_fm_types.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod qs_matrix_pools.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"semi_empirical_int_debug.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' semi_empirical_int_debug.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt_types.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_pool_types.mod qs_p_env_types.mod cp_fm_types.mod qs_matrix_pools.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_types.F qs_tddfpt_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:22:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt_types.mod' due to: qs_tddfpt_types.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod cp_control_types.mod cp_para_types.mod qs_p_env_types.mod qs_environment_types.mod cp_fm_types.mod base_hooks.mod cp_fm_struct.mod cp_blacs_env.mod qs_matrix_pools.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt_types.mod' due to: qs_tddfpt_types.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_pool_types.mod qs_p_env_types.mod cp_fm_types.mod qs_matrix_pools.mod kinds.mod cp_blacs_env.mod cp_fm_struct.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_tddfpt_types.mod qs_mo_types.mod qs_p_env_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_types.mod cp_log_handling.mod base_hooks.mod cp_fm_cholesky.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod qs_p_env_methods.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod cp_control_types.mod qs_p_env_types.mod cp_fm_types.mod qs_mo_types.mod qs_tddfpt_types.mod cp_log_handling.mod kinds.mod base_hooks.mod cp_fm_cholesky.mod physcon.mod qs_p_env_methods.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_utils.F qs_tddfpt_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:22:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt_utils.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt_utils.mod' due to: qs_tddfpt_utils.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt_eigensolver.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_eigensolver.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_p_env_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_types.mod qs_tddfpt_types.mod input_constants.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod qs_matrix_pools.mod kinds.mod qs_tddfpt_utils.mod qs_p_env_methods.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt_eigensolver.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_eigensolver.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod qs_p_env_types.mod cp_fm_types.mod qs_environment_types.mod qs_tddfpt_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_tddfpt_utils.mod qs_matrix_pools.mod qs_p_env_methods.mod cp_fm_basic_linalg.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_eigensolver.F qs_tddfpt_eigensolver.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:22:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt_eigensolver.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt_eigensolver.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:25 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt_eigensolver.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt_eigensolver.F90 /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_eigensolver.F:447:13: 447 | IF (mode == 'L') THEN | ^ Warning: 'mode[1]{lb: 1 sz: 1}' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt_eigensolver.mod' due to: qs_tddfpt_eigensolver.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_eigensolver.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_pool_types.mod qs_p_env_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod cp_fm_types.mod qs_tddfpt_types.mod input_constants.mod cp_fm_diag.mod cp_fm_struct.mod cp_blacs_env.mod qs_matrix_pools.mod kinds.mod qs_tddfpt_utils.mod qs_p_env_methods.mod cp_dbcsr_operations.mod physcon.mod cp_fm_basic_linalg.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt_eigensolver.mod' due to: qs_tddfpt_eigensolver.o /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_eigensolver.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_fm_pool_types.mod qs_p_env_types.mod cp_fm_types.mod qs_environment_types.mod qs_tddfpt_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_tddfpt_utils.mod qs_matrix_pools.mod qs_p_env_methods.mod cp_fm_basic_linalg.mod cp_blacs_env.mod base_hooks.mod cp_fm_diag.mod input_constants.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt_module.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_module.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod qs_p_env_types.mod qs_environment_types.mod qs_scf_types.mod qs_tddfpt_types.mod input_section_types.mod qs_ks_types.mod qs_energy_types.mod input_constants.mod qs_ks_methods.mod header.mod xc_pot_saop.mod qs_tddfpt_utils.mod cp_output_handling.mod qs_tddfpt_eigensolver.mod bibliography.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'qs_tddfpt_module.o' due to: /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_module.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_ks_types.mod qs_rho_types.mod qs_scf_types.mod qs_p_env_types.mod qs_environment_types.mod qs_tddfpt_types.mod input_section_types.mod qs_energy_types.mod cp_log_handling.mod cp_output_handling.mod bibliography.mod qs_tddfpt_utils.mod qs_ks_methods.mod base_hooks.mod xc_pot_saop.mod header.mod qs_tddfpt_eigensolver.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/qs_tddfpt_module.F qs_tddfpt_module.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:22:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt_module.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt_module.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"qs_tddfpt_module.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' qs_tddfpt_module.F90 /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'pilaenv_hack.o' due to: /build/reproducible-path/cp2k-8.1/src/pilaenv_hack.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/pilaenv_hack.F pilaenv_hack.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:22:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pilaenv_hack.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pilaenv_hack.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optimize_input.o' due to: /build/reproducible-path/cp2k-8.1/src/optimize_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod cell_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod cp2k_info.mod powell.mod kinds.mod cp_external_control.mod f77_interface.mod cp_output_handling.mod physcon.mod cp_parser_methods.mod message_passing.mod environment.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod machine.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"pilaenv_hack.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' pilaenv_hack.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optimize_input.o' due to: /build/reproducible-path/cp2k-8.1/src/optimize_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod cp_parser_types.mod parallel_rng_types.mod input_section_types.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod cp_output_handling.mod message_passing.mod cp_external_control.mod cp2k_info.mod memory_utilities.mod machine.mod base_hooks.mod input_constants.mod powell.mod environment.mod cp_parser_methods.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/optimize_input.F optimize_input.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:22:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_input.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:30 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_input.F90 /build/reproducible-path/cp2k-8.1/src/optimize_input.F:182:69: 182 | REAL(KIND=dp), DIMENSION(:, :, :), POINTER :: cell_traj, cell_traj_read, force_traj, & | ^ Warning: 'cell_traj.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optimize_basis_types.o' due to: /build/reproducible-path/cp2k-8.1/src/optimize_basis_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 powell.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optimize_basis_types.o' due to: /build/reproducible-path/cp2k-8.1/src/optimize_basis_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 powell.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/optimize_basis_types.F optimize_basis_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:22:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_basis_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_basis_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optimize_basis_types.mod' due to: optimize_basis_types.o /build/reproducible-path/cp2k-8.1/src/optimize_basis_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 powell.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:33 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_basis_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_basis_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optimize_basis_types.mod' due to: optimize_basis_types.o /build/reproducible-path/cp2k-8.1/src/optimize_basis_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 powell.mod base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optimize_basis_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/optimize_basis_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 optimize_basis_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod string_utilities.mod cp_log_handling.mod base_hooks.mod powell.mod cp_files.mod machine.mod kinds.mod cp_parser_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optimize_basis_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/optimize_basis_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod optimize_basis_types.mod cp_parser_types.mod input_section_types.mod cp_log_handling.mod cp_files.mod kinds.mod input_constants.mod powell.mod string_utilities.mod machine.mod cp_parser_methods.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/optimize_basis_utils.F optimize_basis_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:22:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_basis_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_basis_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_basis_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_basis_utils.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optimize_basis_utils.mod' due to: optimize_basis_utils.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optbas_opt_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/optbas_opt_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod cp_gemm_interface.mod cp_fm_diag.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optbas_opt_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/optbas_opt_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod qs_mo_types.mod admm_types.mod kinds.mod cp_fm_diag.mod base_hooks.mod cp_gemm_interface.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/optbas_opt_utils.F optbas_opt_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:22:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optbas_opt_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optbas_opt_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optbas_opt_utils.mod' due to: optbas_opt_utils.o /build/reproducible-path/cp2k-8.1/src/optbas_opt_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 admm_types.mod qs_mo_types.mod cp_fm_types.mod base_hooks.mod cp_gemm_interface.mod cp_fm_diag.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optbas_opt_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optbas_opt_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optbas_opt_utils.mod' due to: optbas_opt_utils.o /build/reproducible-path/cp2k-8.1/src/optbas_opt_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_fm_types.mod qs_mo_types.mod admm_types.mod kinds.mod cp_fm_diag.mod base_hooks.mod cp_gemm_interface.mod cp_fm_basic_linalg.mod cp_dbcsr_operations.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optbas_fenv_manipulation.o' due to: /build/reproducible-path/cp2k-8.1/src/optbas_fenv_manipulation.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 optimize_basis_types.mod cp_fm_pool_types.mod admm_types.mod qs_rho_types.mod qs_neighbor_list_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod basis_set_container_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod qs_ks_types.mod input_constants.mod string_utilities.mod qs_ks_methods.mod cp_fm_struct.mod cp_blacs_env.mod qs_matrix_pools.mod qs_rho_methods.mod kinds.mod qs_mo_io.mod qs_energy_init.mod qs_interactions.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod qs_overlap.mod cp_log_handling.mod base_hooks.mod qs_mo_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optbas_fenv_manipulation.o' due to: /build/reproducible-path/cp2k-8.1/src/optbas_fenv_manipulation.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod scf_control_types.mod cp_fm_pool_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod optimize_basis_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod basis_set_container_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qs_rho_methods.mod qs_interactions.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_matrix_pools.mod qs_mo_methods.mod cp_fm_cholesky.mod string_utilities.mod qs_ks_methods.mod cp_fm_basic_linalg.mod cp_blacs_env.mod base_hooks.mod qs_mo_io.mod qs_energy_init.mod input_constants.mod qs_overlap.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/optbas_fenv_manipulation.F optbas_fenv_manipulation.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:22:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optbas_fenv_manipulation.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optbas_fenv_manipulation.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optbas_fenv_manipulation.mod' due to: optbas_fenv_manipulation.o /build/reproducible-path/cp2k-8.1/src/optbas_fenv_manipulation.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 optimize_basis_types.mod cp_fm_pool_types.mod admm_types.mod qs_rho_types.mod qs_neighbor_list_types.mod qs_mo_types.mod qs_kind_types.mod basis_set_types.mod cp_para_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod basis_set_container_types.mod cp_fm_types.mod atomic_kind_types.mod scf_control_types.mod input_section_types.mod qs_ks_types.mod input_constants.mod string_utilities.mod qs_ks_methods.mod cp_fm_struct.mod cp_blacs_env.mod qs_matrix_pools.mod qs_rho_methods.mod kinds.mod qs_mo_io.mod qs_energy_init.mod qs_interactions.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod cp_fm_cholesky.mod qs_overlap.mod cp_log_handling.mod base_hooks.mod qs_mo_methods.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optbas_fenv_manipulation.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optbas_fenv_manipulation.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optbas_fenv_manipulation.mod' due to: optbas_fenv_manipulation.o /build/reproducible-path/cp2k-8.1/src/optbas_fenv_manipulation.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod scf_control_types.mod cp_fm_pool_types.mod particle_types.mod qs_rho_types.mod qs_mo_types.mod admm_types.mod optimize_basis_types.mod cp_fm_types.mod atomic_kind_types.mod qs_environment_types.mod basis_set_types.mod qs_neighbor_list_types.mod qs_kind_types.mod input_section_types.mod cp_control_types.mod basis_set_container_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod qs_rho_methods.mod qs_interactions.mod cp_fm_struct.mod cp_dbcsr_operations.mod qs_matrix_pools.mod qs_mo_methods.mod cp_fm_cholesky.mod string_utilities.mod qs_ks_methods.mod cp_fm_basic_linalg.mod cp_blacs_env.mod base_hooks.mod qs_mo_io.mod qs_energy_init.mod input_constants.mod qs_overlap.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optimize_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/optimize_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 optimize_basis_types.mod cp_para_types.mod qs_environment_types.mod force_env_types.mod cp_fm_types.mod input_section_types.mod qs_ks_types.mod admm_methods.mod input_cp2k_read.mod powell.mod optimize_basis_utils.mod cp_blacs_env.mod kinds.mod f77_interface.mod message_passing.mod cp_para_env.mod optbas_opt_utils.mod cp_log_handling.mod base_hooks.mod qs_neighbor_lists.mod optbas_fenv_manipulation.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'optimize_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/optimize_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_ks_types.mod force_env_types.mod optimize_basis_types.mod cp_fm_types.mod qs_environment_types.mod input_section_types.mod cp_log_handling.mod kinds.mod f77_interface.mod optimize_basis_utils.mod message_passing.mod input_cp2k_read.mod qs_neighbor_lists.mod cp_para_env.mod cp_blacs_env.mod machine.mod base_hooks.mod powell.mod optbas_opt_utils.mod optbas_fenv_manipulation.mod admm_methods.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/optimize_basis.F optimize_basis.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:00 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_basis.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_vectors.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_vectors.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 particle_types.mod qs_subsys_types.mod kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"optimize_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' optimize_basis.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_vectors.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_vectors.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_subsys_types.mod particle_types.mod base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_vectors.F negf_vectors.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_vectors.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_vectors.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_alloc_types.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_alloc_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_vectors.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_vectors.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_alloc_types.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_alloc_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_alloc_types.F negf_alloc_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_alloc_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_alloc_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_alloc_types.mod' due to: negf_alloc_types.o /build/reproducible-path/cp2k-8.1/src/negf_alloc_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_alloc_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_alloc_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_alloc_types.mod' due to: negf_alloc_types.o /build/reproducible-path/cp2k-8.1/src/negf_alloc_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_control_types.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_control_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod input_section_types.mod cp_subsys_types.mod negf_alloc_types.mod particle_types.mod input_constants.mod string_utilities.mod base_hooks.mod mathconstants.mod util.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_control_types.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_control_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_types.mod negf_alloc_types.mod particle_types.mod input_section_types.mod molecule_kind_types.mod util.mod mathconstants.mod kinds.mod input_constants.mod physcon.mod string_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_control_types.F negf_control_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_control_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_control_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_control_types.mod' due to: negf_control_types.o /build/reproducible-path/cp2k-8.1/src/negf_control_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_types.mod molecule_types.mod input_section_types.mod cp_subsys_types.mod negf_alloc_types.mod particle_types.mod input_constants.mod string_utilities.mod base_hooks.mod mathconstants.mod util.mod physcon.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_control_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_control_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_control_types.mod' due to: negf_control_types.o /build/reproducible-path/cp2k-8.1/src/negf_control_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod molecule_types.mod negf_alloc_types.mod particle_types.mod input_section_types.mod molecule_kind_types.mod util.mod mathconstants.mod kinds.mod input_constants.mod physcon.mod string_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_subgroup_types.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_subgroup_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod negf_control_types.mod base_hooks.mod message_passing.mod cp_blacs_env.mod cp_para_env.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_subgroup_types.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_subgroup_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod negf_control_types.mod message_passing.mod cp_blacs_env.mod cp_para_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_subgroup_types.F negf_subgroup_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:10 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_subgroup_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_subgroup_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_subgroup_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_subgroup_types.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_subgroup_types.mod' due to: negf_subgroup_types.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_atom_map.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_atom_map.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod qs_kind_types.mod qs_subsys_types.mod cell_types.mod particle_types.mod base_hooks.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_atom_map.F negf_atom_map.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:10 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_atom_map.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_atom_map.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_atom_map.mod' due to: negf_atom_map.o /build/reproducible-path/cp2k-8.1/src/negf_atom_map.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atomic_kind_types.mod qs_kind_types.mod qs_subsys_types.mod cell_types.mod particle_types.mod base_hooks.mod kinds.mod -true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_vectors.mod' due to: negf_vectors.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_matrix_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_matrix_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_kind_types.mod particle_types.mod qs_subsys_types.mod negf_alloc_types.mod cp_fm_types.mod base_hooks.mod message_passing.mod negf_atom_map.mod cp_fm_basic_linalg.mod kinds.mod particle_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_atom_map.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_atom_map.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod particle_types.mod cell_types.mod qs_subsys_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_atom_map.F negf_atom_map.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_atom_map.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_atom_map.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_atom_map.mod' due to: negf_atom_map.o /build/reproducible-path/cp2k-8.1/src/negf_atom_map.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_kind_types.mod particle_types.mod cell_types.mod qs_subsys_types.mod atomic_kind_types.mod kinds.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_matrix_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_matrix_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_kind_types.mod negf_alloc_types.mod particle_types.mod cp_fm_types.mod qs_subsys_types.mod message_passing.mod kinds.mod base_hooks.mod negf_atom_map.mod particle_methods.mod cp_fm_basic_linalg.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_matrix_utils.F negf_matrix_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_matrix_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_matrix_utils.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_matrix_utils.mod' due to: negf_matrix_utils.o /build/reproducible-path/cp2k-8.1/src/negf_matrix_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_kind_types.mod particle_types.mod qs_subsys_types.mod negf_alloc_types.mod cp_fm_types.mod base_hooks.mod message_passing.mod negf_atom_map.mod cp_fm_basic_linalg.mod kinds.mod particle_methods.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_matrix_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_matrix_utils.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_matrix_utils.mod' due to: negf_matrix_utils.o /build/reproducible-path/cp2k-8.1/src/negf_matrix_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod qs_kind_types.mod negf_alloc_types.mod particle_types.mod cp_fm_types.mod qs_subsys_types.mod message_passing.mod kinds.mod base_hooks.mod negf_atom_map.mod particle_methods.mod cp_fm_basic_linalg.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod negf_control_types.mod pw_types.mod qs_subsys_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod negf_subgroup_types.mod pw_pool_types.mod qs_density_mixing_types.mod force_env_types.mod cp_fm_types.mod input_section_types.mod qs_energy.mod negf_atom_map.mod negf_vectors.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod qs_energy_init.mod qs_integrate_potential.mod message_passing.mod negf_matrix_utils.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_env_types.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_env_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod negf_subgroup_types.mod kpoint_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod negf_control_types.mod force_env_types.mod qs_mo_types.mod cp_fm_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod qs_subsys_types.mod qs_density_mixing_types.mod cp_control_types.mod kinds.mod qs_integrate_potential.mod cp_fm_struct.mod negf_vectors.mod message_passing.mod negf_atom_map.mod cp_blacs_env.mod qs_energy.mod base_hooks.mod negf_matrix_utils.mod qs_energy_init.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_env_types.F negf_env_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_env_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_env_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_env_types.F90 /build/reproducible-path/cp2k-8.1/src/negf_env_types.F:1051:13: 1051 | IF (imo == 0) THEN @@ -48192,36 +48227,36 @@ 995 | INTEGER :: handle, homo, ikpgr, ikpoint, imo, & | ^ note: 'imo' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_env_types.mod' due to: negf_env_types.o /build/reproducible-path/cp2k-8.1/src/negf_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod negf_control_types.mod pw_types.mod qs_subsys_types.mod cell_types.mod qs_mo_types.mod kpoint_types.mod cp_para_types.mod pw_env_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod negf_subgroup_types.mod pw_pool_types.mod qs_density_mixing_types.mod force_env_types.mod cp_fm_types.mod input_section_types.mod qs_energy.mod negf_atom_map.mod negf_vectors.mod cp_fm_struct.mod cp_blacs_env.mod kinds.mod qs_energy_init.mod qs_integrate_potential.mod message_passing.mod negf_matrix_utils.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_green_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_green_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod base_hooks.mod mathconstants.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_green_methods.F negf_green_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_green_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_green_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_green_methods.mod' due to: negf_green_methods.o /build/reproducible-path/cp2k-8.1/src/negf_green_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod base_hooks.mod mathconstants.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_env_types.mod' due to: negf_env_types.o /build/reproducible-path/cp2k-8.1/src/negf_env_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod negf_subgroup_types.mod kpoint_types.mod pw_pool_types.mod particle_types.mod cell_types.mod qs_rho_types.mod negf_control_types.mod force_env_types.mod qs_mo_types.mod cp_fm_types.mod qs_environment_types.mod pw_env_types.mod pw_types.mod input_section_types.mod qs_subsys_types.mod qs_density_mixing_types.mod cp_control_types.mod kinds.mod qs_integrate_potential.mod cp_fm_struct.mod negf_vectors.mod message_passing.mod negf_atom_map.mod cp_blacs_env.mod qs_energy.mod base_hooks.mod negf_matrix_utils.mod qs_energy_init.mod true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_green_cache.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_green_cache.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod base_hooks.mod util.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_green_cache.F negf_green_cache.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_green_cache.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_green_cache.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_green_cache.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_green_cache.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_green_cache.mod' due to: negf_green_cache.o /build/reproducible-path/cp2k-8.1/src/negf_green_cache.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod base_hooks.mod util.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_integr_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_integr_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/negf_integr_utils.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_green_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_green_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod cp_cfm_basic_linalg.mod mathconstants.mod kinds.mod cp_fm_struct.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_green_methods.F negf_green_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_green_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_green_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_green_methods.mod' due to: negf_green_methods.o /build/reproducible-path/cp2k-8.1/src/negf_green_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod cp_cfm_basic_linalg.mod mathconstants.mod kinds.mod cp_fm_struct.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_integr_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_integr_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/negf_integr_utils.fypp base_hooks.mod mathconstants.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_integr_utils.F negf_integr_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_integr_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_integr_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_integr_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_integr_utils.F90 /build/reproducible-path/cp2k-8.1/src/negf_integr_utils.F:181:3: 181 | PURE FUNCTION get_axis_rotation_angle(a, b) RESULT(phi) | ^ Warning: 'get_axis_rotation_angle' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_integr_utils.mod' due to: negf_integr_utils.o /build/reproducible-path/cp2k-8.1/src/negf_integr_utils.F /build/reproducible-path/cp2k-8.1/src/negf_integr_utils.fypp /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mathconstants.mod kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_integr_utils.mod' due to: negf_integr_utils.o /build/reproducible-path/cp2k-8.1/src/negf_integr_utils.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 /build/reproducible-path/cp2k-8.1/src/negf_integr_utils.fypp base_hooks.mod mathconstants.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_integr_simpson.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_integr_simpson.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod negf_integr_utils.mod base_hooks.mod mathconstants.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod util.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_integr_simpson.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_integr_simpson.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod util.mod cp_cfm_basic_linalg.mod mathconstants.mod kinds.mod negf_integr_utils.mod cp_fm_struct.mod cp_fm_basic_linalg.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_integr_simpson.F negf_integr_simpson.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_integr_simpson.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_integr_simpson.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_integr_simpson.mod' due to: negf_integr_simpson.o /build/reproducible-path/cp2k-8.1/src/negf_integr_simpson.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod negf_integr_utils.mod base_hooks.mod mathconstants.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod util.mod cp_fm_basic_linalg.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_integr_simpson.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_integr_simpson.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_integr_simpson.mod' due to: negf_integr_simpson.o /build/reproducible-path/cp2k-8.1/src/negf_integr_simpson.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod util.mod cp_cfm_basic_linalg.mod mathconstants.mod kinds.mod negf_integr_utils.mod cp_fm_struct.mod cp_fm_basic_linalg.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_integr_cc.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_integr_cc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod negf_integr_utils.mod base_hooks.mod mathconstants.mod cp_cfm_basic_linalg.mod fft_tools.mod cp_fm_struct.mod kahan_sum.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_integr_cc.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_integr_cc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod cp_cfm_basic_linalg.mod kahan_sum.mod kinds.mod mathconstants.mod negf_integr_utils.mod fft_tools.mod cp_fm_struct.mod cp_fm_basic_linalg.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_integr_cc.F negf_integr_cc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_integr_cc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_integr_cc.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:20:59 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_integr_cc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_integr_cc.F90 /build/reproducible-path/cp2k-8.1/src/negf_integr_cc.F:400:51: 400 | ALLOCATE (cc_env%zdata_cache(nnodes_half)) @@ -48232,11 +48267,11 @@ 273 | ALLOCATE (xnodes_next(nnodes_next)) | ^ Warning: 'nnodes_next' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_integr_cc.mod' due to: negf_integr_cc.o /build/reproducible-path/cp2k-8.1/src/negf_integr_cc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod negf_integr_utils.mod base_hooks.mod mathconstants.mod cp_cfm_basic_linalg.mod fft_tools.mod cp_fm_struct.mod kahan_sum.mod cp_fm_basic_linalg.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_integr_cc.mod' due to: negf_integr_cc.o /build/reproducible-path/cp2k-8.1/src/negf_integr_cc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_cfm_types.mod cp_fm_types.mod cp_cfm_basic_linalg.mod kahan_sum.mod kinds.mod mathconstants.mod negf_integr_utils.mod fft_tools.mod cp_fm_struct.mod cp_fm_basic_linalg.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_rho_types.mod negf_control_types.mod qs_subsys_types.mod kpoint_types.mod cp_para_types.mod negf_env_types.mod qs_environment_types.mod cp_control_types.mod negf_subgroup_types.mod cp_subsys_types.mod qs_density_mixing_types.mod force_env_types.mod cp_fm_types.mod cp_cfm_types.mod global_types.mod input_section_types.mod negf_green_methods.mod input_constants.mod qs_mixing_utils.mod string_utilities.mod mathconstants.mod qs_ks_methods.mod cp_cfm_basic_linalg.mod cp_fm_struct.mod cp_blacs_env.mod qs_rho_methods.mod kinds.mod negf_green_cache.mod negf_integr_simpson.mod cp_output_handling.mod cp_dbcsr_operations.mod cp_fm_basic_linalg.mod physcon.mod negf_integr_cc.mod message_passing.mod negf_matrix_utils.mod bibliography.mod qs_scf_methods.mod cp_log_handling.mod base_hooks.mod machine.mod qs_gspace_mixing.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'negf_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/negf_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod negf_subgroup_types.mod kpoint_types.mod qs_rho_types.mod negf_control_types.mod force_env_types.mod global_types.mod cp_fm_types.mod negf_env_types.mod qs_environment_types.mod input_section_types.mod qs_subsys_types.mod cp_cfm_types.mod qs_density_mixing_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod qs_mixing_utils.mod physcon.mod cp_output_handling.mod qs_rho_methods.mod cp_fm_struct.mod bibliography.mod cp_dbcsr_operations.mod message_passing.mod cp_cfm_basic_linalg.mod negf_green_cache.mod negf_green_methods.mod negf_integr_simpson.mod string_utilities.mod qs_ks_methods.mod cp_fm_basic_linalg.mod cp_blacs_env.mod machine.mod base_hooks.mod negf_matrix_utils.mod mathconstants.mod input_constants.mod qs_gspace_mixing.mod qs_scf_methods.mod negf_integr_cc.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/negf_methods.F negf_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:23:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"negf_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' negf_methods.F90 /build/reproducible-path/cp2k-8.1/src/negf_methods.F:1409:80: 1409 | TYPE(cp_cfm_p_type), ALLOCATABLE, DIMENSION(:, :) :: gamma_contacts_group, & @@ -48264,74 +48299,74 @@ 2946 | INTEGER :: handle, icontact, ipoint, ispin, & | ^ note: 'ipoint' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mscfg_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/mscfg_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mscfg_types.mod cell_types.mod qs_mo_types.mod cp_para_types.mod qs_environment_types.mod almo_scf_types.mod cp_subsys_types.mod force_env_types.mod particle_list_types.mod global_types.mod atomic_kind_types.mod input_section_types.mod molecule_types.mod qs_energy_types.mod qs_environment.mod input_constants.mod qs_energy.mod kinds.mod cp_dbcsr_operations.mod cp_subsys_methods.mod cp_log_handling.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mscfg_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/mscfg_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod mscfg_types.mod cell_types.mod qs_mo_types.mod force_env_types.mod almo_scf_types.mod molecule_types.mod particle_list_types.mod global_types.mod atomic_kind_types.mod qs_environment_types.mod input_section_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod cp_dbcsr_operations.mod cp_subsys_methods.mod qs_environment.mod qs_energy.mod base_hooks.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mscfg_methods.F mscfg_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mscfg_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mscfg_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:08 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mscfg_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mscfg_methods.F90 /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mao_types.o' due to: /build/reproducible-path/cp2k-8.1/src/mao_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/mao_types.F mao_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"mao_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mao_types.F90 /build/reproducible-path/cp2k-8.1/src/mao_types.F:38:29: 38 | SUBROUTINE create_mao_type(mao_env) | ^ Warning: 'create_mao_type' defined but not used [-Wunused-function] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_coulomb_test.mod' due to: ai_coulomb_test.o +true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cg_test.mod' due to: cg_test.o true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'shg_integrals_test.mod' due to: shg_integrals_test.o true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ai_coulomb_test.mod' due to: ai_coulomb_test.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'library_tests.o' due to: /build/reproducible-path/cp2k-8.1/src/library_tests.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 realspace_grid_types.mod pw_types.mod parallel_rng_types.mod cell_types.mod cp_para_types.mod pw_grid_types.mod cp_fm_types.mod global_types.mod input_section_types.mod input_constants.mod cp_realspace_grid_init.mod pw_methods.mod cp_gemm_interface.mod cp_fm_diag.mod pw_grids.mod cp_fm_struct.mod cp_blacs_env.mod cp_files.mod mp2_grids.mod cg_test.mod kinds.mod cp_output_handling.mod cp_fm_basic_linalg.mod message_passing.mod shg_integrals_test.mod minimax_exp.mod cp_log_handling.mod base_hooks.mod cp_eri_mme_interface.mod machine.mod fft_tools.mod ai_coulomb_test.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'library_tests.o' due to: /build/reproducible-path/cp2k-8.1/src/library_tests.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod parallel_rng_types.mod global_types.mod cp_fm_types.mod pw_grid_types.mod pw_types.mod input_section_types.mod realspace_grid_types.mod minimax_exp.mod cp_log_handling.mod kinds.mod pw_grids.mod cp_gemm_interface.mod cp_output_handling.mod fft_tools.mod mp2_grids.mod cp_fm_struct.mod ai_coulomb_test.mod message_passing.mod cp_fm_basic_linalg.mod cp_eri_mme_interface.mod cp_files.mod pw_methods.mod cp_realspace_grid_init.mod cp_blacs_env.mod cg_test.mod machine.mod base_hooks.mod shg_integrals_test.mod cp_fm_diag.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/library_tests.F library_tests.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"library_tests.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' library_tests.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"library_tests.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' library_tests.F90 /build/reproducible-path/cp2k-8.1/src/library_tests.F:925:21: 925 | ELSE IF (is_fullspace) THEN | ^ Warning: 'is_fullspace' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ipi_driver.o' due to: /build/reproducible-path/cp2k-8.1/src/ipi_driver.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod input_section_types.mod virial_types.mod cp_subsys_types.mod force_env_types.mod cell_types.mod cp_log_handling.mod force_env_methods.mod message_passing.mod base_hooks.mod cp_external_control.mod bibliography.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'ipi_driver.o' due to: /build/reproducible-path/cp2k-8.1/src/ipi_driver.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod input_section_types.mod global_types.mod cell_types.mod force_env_types.mod virial_types.mod message_passing.mod cp_external_control.mod cp_log_handling.mod kinds.mod base_hooks.mod force_env_methods.mod bibliography.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/ipi_driver.F ipi_driver.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ipi_driver.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ipi_driver.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"ipi_driver.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' ipi_driver.F90 /build/reproducible-path/cp2k-8.1/src/ipi_driver.F:209:26: 209 | SUBROUTINE readbuffer_d(psockfd, fdata) | ^ Warning: 'readbuffer_d' defined but not used [-Wunused-function] -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_optimize_input.o' due to: /build/reproducible-path/cp2k-8.1/src/input_optimize_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_optimize_input.o' due to: /build/reproducible-path/cp2k-8.1/src/input_optimize_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_optimize_input.F input_optimize_input.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:27 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_optimize_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_optimize_input.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_optimize_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/input_optimize_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_optimize_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_optimize_input.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_optimize_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/input_optimize_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod string_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_optimize_basis.F input_optimize_basis.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_optimize_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_optimize_basis.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_negf.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_negf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod qs_density_mixing_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod physcon.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_optimize_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_optimize_basis.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_negf.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_negf.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod qs_density_mixing_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod physcon.mod cp_output_handling.mod string_utilities.mod bibliography.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_negf.F input_cp2k_negf.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_negf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_negf.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_constraints.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_constraints.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod cell_types.mod input_constants.mod string_utilities.mod base_hooks.mod cp_output_handling.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_negf.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_negf.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_constraints.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_constraints.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod cell_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_constraints.F input_cp2k_constraints.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:31 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_constraints.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_constraints.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_xc.mod input_constants.mod string_utilities.mod base_hooks.mod cp_output_handling.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_constraints.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_constraints.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_atom.o' due to: /build/reproducible-path/cp2k-8.1/src/input_cp2k_atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_cp2k_xc.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/input_cp2k_atom.F input_cp2k_atom.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:32 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_atom.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'farming_types.o' due to: /build/reproducible-path/cp2k-8.1/src/farming_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"input_cp2k_atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_atom.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'farming_types.o' due to: /build/reproducible-path/cp2k-8.1/src/farming_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/farming_types.F farming_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"farming_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' farming_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"farming_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' farming_types.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'farming_types.mod' due to: farming_types.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'farming_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/farming_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod farming_types.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp_output_handling.mod cp_files.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'farming_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/farming_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod farming_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod cp_files.mod cp_output_handling.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/farming_methods.F farming_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"farming_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' farming_methods.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp2k_debug.o' due to: /build/reproducible-path/cp2k-8.1/src/cp2k_debug.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod qs_kind_types.mod cp_para_types.mod virial_types.mod qs_environment_types.mod cp_control_types.mod particle_types.mod cp_subsys_types.mod force_env_types.mod cp_result_types.mod input_section_types.mod input_constants.mod cp_result_methods.mod kinds.mod force_env_methods.mod cp_output_handling.mod particle_methods.mod cp_log_handling.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"farming_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' farming_methods.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp2k_debug.o' due to: /build/reproducible-path/cp2k-8.1/src/cp2k_debug.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cp_result_types.mod particle_types.mod cell_types.mod force_env_types.mod qs_environment_types.mod qs_kind_types.mod input_section_types.mod virial_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod force_env_methods.mod cp_result_methods.mod particle_methods.mod base_hooks.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/cp2k_debug.F cp2k_debug.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp2k_debug.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k_debug.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'bsse.o' due to: /build/reproducible-path/cp2k-8.1/src/bsse.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cell_types.mod cp_para_types.mod qs_environment_types.mod cp_subsys_types.mod force_env_types.mod particle_list_types.mod global_types.mod atomic_kind_types.mod input_section_types.mod qs_energy_types.mod qs_environment.mod input_constants.mod string_utilities.mod qs_energy.mod cp2k_info.mod kinds.mod cp_external_control.mod cp_output_handling.mod cp_subsys_methods.mod memory_utilities.mod cp_log_handling.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:21 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"cp2k_debug.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k_debug.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'bsse.o' due to: /build/reproducible-path/cp2k-8.1/src/bsse.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cell_types.mod force_env_types.mod particle_list_types.mod global_types.mod atomic_kind_types.mod qs_environment_types.mod input_section_types.mod qs_energy_types.mod cp_log_handling.mod kinds.mod cp_output_handling.mod cp_external_control.mod string_utilities.mod cp_subsys_methods.mod cp2k_info.mod memory_utilities.mod qs_environment.mod qs_energy.mod base_hooks.mod input_constants.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/bsse.F bsse.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"bsse.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bsse.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_pseudo.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_pseudo.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod input_constants.mod periodic_table.mod cp_log_handling.mod base_hooks.mod atom_utils.mod atom_output.mod atom_electronic_structure.mod cp_output_handling.mod atom_fit.mod atom_operators.mod physcon.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:23 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"bsse.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' bsse.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_pseudo.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_pseudo.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod atom_operators.mod cp_log_handling.mod kinds.mod atom_utils.mod input_constants.mod physcon.mod cp_output_handling.mod atom_electronic_structure.mod periodic_table.mod atom_output.mod atom_fit.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_pseudo.F atom_pseudo.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_pseudo.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_pseudo.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_grb.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_grb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod input_constants.mod ai_onecenter.mod periodic_table.mod base_hooks.mod lapack.mod mathconstants.mod orbital_pointers.mod atom_utils.mod powell.mod orbital_transformation_matrices.mod atom_electronic_structure.mod cp_files.mod qs_grid_atom.mod physcon.mod atom_operators.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:26 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_pseudo.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_pseudo.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_grb.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_grb.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod atom_operators.mod lapack.mod mathconstants.mod cp_files.mod kinds.mod orbital_pointers.mod atom_utils.mod orbital_transformation_matrices.mod ai_onecenter.mod input_constants.mod physcon.mod powell.mod atom_electronic_structure.mod periodic_table.mod qs_grid_atom.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_grb.F atom_grb.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:24:50 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_grb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_grb.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:28 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_grb.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_grb.F90 /build/reproducible-path/cp2k-8.1/src/atom_grb.F:763:23: 763 | nval = lmax @@ -48369,19 +48404,19 @@ Warning: 'fhomo' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_grb.mod' due to: atom_grb.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_admm_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_admm_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod input_constants.mod mathlib.mod base_hooks.mod atom_xc.mod atom_utils.mod atom_output.mod atom_operators.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_admm_methods.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_admm_methods.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod atom_operators.mod atom_xc.mod mathlib.mod kinds.mod atom_utils.mod input_constants.mod atom_output.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_admm_methods.F atom_admm_methods.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:25:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_admm_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_admm_methods.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:36 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_admm_methods.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_admm_methods.F90 /build/reproducible-path/cp2k-8.1/src/atom_admm_methods.F:213:19: 213 | IF (rhf) THEN | ^ Warning: 'rhf' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_admm_methods.mod' due to: atom_admm_methods.o /build/reproducible-path/cp2k-8.1/src/atom_admm_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod input_constants.mod mathlib.mod base_hooks.mod atom_xc.mod atom_utils.mod atom_output.mod atom_operators.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_admm_methods.mod' due to: atom_admm_methods.o /build/reproducible-path/cp2k-8.1/src/atom_admm_methods.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod atom_operators.mod atom_xc.mod mathlib.mod kinds.mod atom_utils.mod input_constants.mod atom_output.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_energy.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_energy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod input_constants.mod mathconstants.mod atom_fit.mod kinds.mod atom_grb.mod atom_electronic_structure.mod cp_output_handling.mod physcon.mod atom_operators.mod atom_sgp.mod atom_xc.mod atom_utils.mod periodic_table.mod cp_log_handling.mod base_hooks.mod atom_output.mod atom_admm_methods.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_energy.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_energy.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod periodic_table.mod atom_fit.mod atom_grb.mod atom_utils.mod atom_xc.mod base_hooks.mod atom_operators.mod mathconstants.mod atom_sgp.mod input_constants.mod atom_electronic_structure.mod atom_admm_methods.mod atom_output.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_energy.F atom_energy.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:25:24 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_energy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_energy.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_energy.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_energy.F90 /build/reproducible-path/cp2k-8.1/src/atom_energy.F:530:54: 530 | state%occupation(lhomo, nhomo) = fhomo + dene @@ -48392,18 +48427,18 @@ 492 | REAL(KIND=dp) :: dene, emax, expzet, fhomo, o, prefac, & | ^ note: 'fhomo' was declared here -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_types.mod input_constants.mod periodic_table.mod cp_log_handling.mod base_hooks.mod atom_utils.mod atom_output.mod cp_output_handling.mod atom_fit.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom_basis.o' due to: /build/reproducible-path/cp2k-8.1/src/atom_basis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 atom_types.mod input_section_types.mod cp_log_handling.mod kinds.mod atom_utils.mod input_constants.mod cp_output_handling.mod periodic_table.mod atom_output.mod atom_fit.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom_basis.F atom_basis.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:25:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_basis.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom_basis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom_basis.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_basis.mod' due to: atom_basis.o true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_energy.mod' due to: atom_energy.o -true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_pseudo.mod' due to: atom_pseudo.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom.o' due to: /build/reproducible-path/cp2k-8.1/src/atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_basis.mod input_constants.mod periodic_table.mod cp_log_handling.mod base_hooks.mod cp_output_handling.mod atom_energy.mod header.mod atom_pseudo.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom_energy.mod' due to: atom_energy.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'atom.o' due to: /build/reproducible-path/cp2k-8.1/src/atom.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod atom_basis.mod cp_log_handling.mod atom_pseudo.mod header.mod kinds.mod input_constants.mod cp_output_handling.mod atom_energy.mod periodic_table.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/atom.F atom.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:25:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:49 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"atom.F\"" -I'/build/reproducible-path/cp2k-8.1/src/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' atom.F90 /build/reproducible-path/cp2k-8.1/Makefile:508: update target 'sockets.o' due to: /build/reproducible-path/cp2k-8.1/src/sockets.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/sockets.c /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a' due to: xtb_types.o xtb_parameters.o xtb_matrices.o xtb_ehess.o xtb_coulomb.o xray_diffraction.o xc_write_output.o xc_pot_saop.o xc_adiabatic_utils.o xc_adiabatic_methods.o xas_tp_scf.o xas_tdp_utils.o xas_tdp_types.o xas_tdp_methods.o xas_tdp_kernel.o xas_tdp_integrals.o xas_tdp_correction.o xas_tdp_atom.o xas_restart.o xas_methods.o xas_env_types.o xas_control.o wannier_states_types.o wannier_states.o wannier90.o voronoi_interface.o virial_methods.o uff_vdw_radii_table.o transport_env_types.o transport.o topology_xyz.o topology_xtl.o topology_util.o topology_types.o topology_psf.o topology_pdb.o topology_multiple_unit_cell.o topology_input.o topology_gromos.o topology_generate_util.o topology_cp2k.o topology_coordinate_util.o topology_constraint_util.o topology_connectivity_util.o topology_cif.o topology_amber.o topology.o task_list_types.o task_list_methods.o taper_types.o surface_dipole.o submatrix_types.o submatrix_dissection.o subcell_types.o stm_images.o statistical_methods.o spme.o splines_types.o splines_methods.o spglib_f08.o sirius_interface.o simpar_types.o shg_integrals_test.o semi_empirical_utils.o semi_empirical_types.o semi_empirical_store_int_types.o semi_empirical_parameters.o semi_empirical_par_utils.o semi_empirical_mpole_types.o semi_empirical_mpole_methods.o semi_empirical_integrals.o semi_empirical_int_utils.o semi_empirical_int_num.o semi_empirical_int_gks.o semi_empirical_int_debug.o semi_empirical_int_arrays.o semi_empirical_int_ana.o semi_empirical_int3_utils.o semi_empirical_expns3_types.o semi_empirical_expns3_methods.o se_fock_matrix_integrals.o se_fock_matrix_exchange.o se_fock_matrix_dbg.o se_fock_matrix_coulomb.o se_fock_matrix.o se_core_matrix.o se_core_core.o scine_utils.o scf_control_types.o sap_kind_types.o s_square_methods.o rtp_admm_methods.o rt_propagation_types.o rt_propagation_forces.o rpa_util.o rpa_rse.o rpa_main.o rpa_kpoints.o rpa_im_time.o rpa_gw_kpoints.o rpa_gw_im_time_util.o rpa_gw_ic.o rpa_gw.o rpa_communication.o rpa_axk.o rmsd.o ri_environment_methods.o restraint.o response_solver.o replica_types.o replica_methods.o rel_control_types.o qs_wf_history_types.o qs_wf_history_methods.o qs_wannier90.o qs_vxc_atom.o qs_vxc.o qs_update_s_mstruct.o qs_tensors_types.o qs_tensors.o qs_tddfpt_utils.o qs_tddfpt_types.o qs_tddfpt_module.o qs_tddfpt_eigensolver.o qs_tddfpt2_utils.o qs_tddfpt2_types.o qs_tddfpt2_subgroups.o qs_tddfpt2_stda_utils.o qs_tddfpt2_stda_types.o qs_tddfpt2_restart.o qs_tddfpt2_properties.o qs_tddfpt2_operators.o qs_tddfpt2_methods.o qs_tddfpt2_fhxc.o qs_tddfpt2_eigensolver.o qs_tddfpt2_densities.o qs_subsys_types.o qs_subsys_methods.o qs_spin_orbit.o qs_scf_wfn_mix.o qs_scf_types.o qs_scf_post_tb.o qs_scf_post_se.o qs_scf_post_scf.o qs_scf_post_gpw.o qs_scf_output.o qs_scf_methods.o qs_scf_loop_utils.o qs_scf_lanczos.o qs_scf_initialization.o qs_scf_diagonalization.o qs_scf_csr_write.o qs_scf_block_davidson.o qs_scf.o qs_sccs.o qs_rho_types.o qs_rho_methods.o qs_rho_atom_types.o qs_rho_atom_methods.o qs_rho0_types.o qs_rho0_methods.o qs_rho0_ggrid.o qs_resp.o qs_period_efield_types.o qs_pdos.o qs_p_env_types.o qs_p_env_methods.o qs_overlap.o qs_outer_scf.o qs_ot_types.o qs_ot_scf.o qs_ot_minimizer.o qs_ot_eigensolver.o qs_ot.o qs_operators_ao.o qs_oce_types.o qs_oce_methods.o qs_o3c_types.o qs_o3c_methods.o qs_nl_hash_table_types.o qs_neighbor_lists.o qs_neighbor_list_types.o qs_moments.o qs_mom_types.o qs_mom_methods.o qs_mo_types.o qs_mo_occupation.o qs_mo_methods.o qs_mo_io.o qs_mixing_utils.o qs_matrix_pools.o qs_localization_methods.o qs_local_rho_types.o qs_local_properties.o qs_loc_utils.o qs_loc_types.o qs_loc_states.o qs_loc_molecules.o qs_loc_methods.o qs_loc_dipole.o qs_linres_types.o qs_linres_polar_utils.o qs_linres_op.o qs_linres_nmr_utils.o qs_linres_nmr_shift.o qs_linres_nmr_epr_common_utils.o qs_linres_module.o qs_linres_methods.o qs_linres_issc_utils.o qs_linres_epr_utils.o qs_linres_epr_ownutils.o qs_linres_epr_nablavks.o qs_linres_current_utils.o qs_linres_current.o qs_linres_atom_current.o qs_ks_utils.o qs_ks_types.o qs_ks_qmmm_types.o qs_ks_qmmm_methods.o qs_ks_methods.o qs_ks_atom.o qs_ks_apply_restraints.o qs_kpp1_env_types.o qs_kpp1_env_methods.o qs_kinetic.o qs_kind_types.o qs_interactions.o qs_integrate_potential_single.o qs_integrate_potential_product.o qs_integrate_potential.o qs_integral_utils.o qs_initial_guess.o qs_hash_table_functions.o qs_harmonics_atom.o qs_gspace_mixing.o qs_grid_atom.o qs_gcp_utils.o qs_gcp_types.o qs_gcp_method.o qs_gapw_densities.o qs_gamma2kp.o qs_force_types.o qs_force.o qs_fermi_contact.o qs_fb_trial_fns_types.o qs_fb_matrix_data_types.o qs_fb_input.o qs_fb_hash_table_types.o qs_fb_filter_matrix_methods.o qs_fb_env_types.o qs_fb_env_methods.o qs_fb_distribution_methods.o qs_fb_com_tasks_types.o qs_fb_buffer_types.o qs_fb_atomic_matrix_methods.o qs_fb_atomic_halo_types.o qs_external_potential.o qs_external_density.o qs_epr_hyp.o qs_environment_types.o qs_environment_methods.o qs_environment.o qs_energy_window.o qs_energy_utils.o qs_energy_types.o qs_energy_matrix_w.o qs_energy_init.o qs_energy.o qs_elf_methods.o qs_electric_field_gradient.o qs_elec_field.o qs_efield_local.o qs_efield_berry.o qs_dos.o qs_dispersion_utils.o qs_dispersion_types.o qs_dispersion_pairpot.o qs_dispersion_nonloc.o qs_diis_types.o qs_diis.o qs_dftb_utils.o qs_dftb_types.o qs_dftb_parameters.o qs_dftb_matrices.o qs_dftb_dispersion.o qs_dftb_coulomb.o qs_dftb3_methods.o qs_density_mixing_types.o qs_core_hamiltonian.o qs_core_energies.o qs_condnum.o qs_commutators.o qs_collocate_density.o qs_charges_types.o qs_chargemol.o qs_charge_mixing.o qs_cdft_utils.o qs_cdft_types.o qs_cdft_scf_utils.o qs_cdft_opt_types.o qs_cdft_methods.o qs_block_davidson_types.o qs_basis_gradient.o qs_band_structure.o qs_active_space_types.o qs_active_space_methods.o qmmmx_util.o qmmmx_update.o qmmmx_types.o qmmmx_force.o qmmmx_create.o qmmm_util.o qmmm_types_low.o qmmm_types.o qmmm_topology_util.o qmmm_tb_methods.o qmmm_tb_coulomb.o qmmm_se_forces.o qmmm_se_energy.o qmmm_pw_grid.o qmmm_per_elpot.o qmmm_links_methods.o qmmm_init.o qmmm_image_charge.o qmmm_gpw_forces.o qmmm_gpw_energy.o qmmm_gaussian_types.o qmmm_gaussian_input.o qmmm_gaussian_init.o qmmm_gaussian_data.o qmmm_force.o qmmm_ff_fist.o qmmm_elpot.o qmmm_create.o pwdft_environment_types.o pwdft_environment.o pw_poisson_read_input.o pw_env_methods.o preconditioner_types.o preconditioner_solvers.o preconditioner_makes.o preconditioner_apply.o preconditioner.o population_analyses.o pme_tools.o pme.o pilaenv_hack.o pexsi_types.o pexsi_methods.o pexsi_interface.o paw_proj_set_types.o particle_methods.o pao_types.o pao_potentials.o pao_param_linpot.o pao_param_gth.o pao_param_fock.o pao_param_exp.o pao_param.o pao_optimizer.o pao_ml_neuralnet.o pao_ml_gaussprocess.o pao_ml_descriptor.o pao_ml.o pao_methods.o pao_main.o pao_linpot_rotinv.o pao_linpot_full.o pao_io.o pao_input.o pair_potential_util.o pair_potential_types.o pair_potential_coulomb.o pair_potential.o outer_scf_control_types.o optimize_input.o optimize_embedding_potential.o optimize_dmfet_potential.o optimize_basis_utils.o optimize_basis_types.o optimize_basis.o optbas_opt_utils.o optbas_fenv_manipulation.o nnp_model.o nnp_force.o nnp_environment_types.o nnp_environment.o nnp_acsf.o negf_vectors.o negf_subgroup_types.o negf_methods.o negf_matrix_utils.o negf_integr_utils.o negf_integr_simpson.o negf_integr_cc.o negf_green_methods.o negf_green_cache.o negf_env_types.o negf_control_types.o negf_atom_map.o negf_alloc_types.o mulliken.o mscfg_types.o mscfg_methods.o mp2_types.o mp2_setup.o mp2_ri_libint.o mp2_ri_grad_util.o mp2_ri_grad.o mp2_ri_gpw.o mp2_ri_2c.o mp2_optimize_ri_basis.o mp2_laplace.o mp2_integrals.o mp2_grids.o mp2_gpw_method.o mp2_gpw.o mp2_eri_gpw.o mp2_eri.o mp2_direct_method.o mp2_cphf.o mp2.o motion_utils.o moments_utils.o molsym.o molecular_states.o molecular_moments.o molecular_dipoles.o molden_utils.o mol_force.o mode_selective.o mm_mapping_library.o mm_collocate_potential.o mixed_main.o mixed_environment_utils.o mixed_environment_types.o mixed_environment.o mixed_energy_types.o mixed_cdft_utils.o mixed_cdft_types.o mixed_cdft_methods.o minbas_wfn_analysis.o minbas_methods.o metadynamics_utils.o metadynamics_types.o metadynamics.o mdctrl_types.o maxwell_solver_interface.o matrix_exp.o mao_wfn_analysis.o mao_types.o mao_optimizer.o mao_methods.o mao_basis.o manybody_tersoff.o manybody_siepmann.o manybody_quip.o manybody_potential.o manybody_gal.o manybody_eam.o ls_matrix_exp.o lri_optimize_ri_basis_types.o lri_optimize_ri_basis.o lri_ks_methods.o lri_integrals.o lri_forces.o lri_environment_types.o lri_environment_methods.o lri_environment_init.o lri_compression.o localization_tb.o linesearch.o library_tests.o libint_wrapper.o libint_2c_3c.o kpoint_types.o kpoint_transitional.o kpoint_methods.o kpoint_io.o kpoint_coulomb_2c.o kg_vertex_coloring_methods.o kg_tnadd_mat.o kg_environment_types.o kg_environment.o kg_correction.o iterate_matrix.o ipi_driver.o integration_grid_types.o input_restart_rng.o input_restart_force_eval.o input_optimize_input.o input_optimize_basis.o input_cp2k_xc.o input_cp2k_transport.o input_cp2k_thermostats.o input_cp2k_tb.o input_cp2k_subsys.o input_cp2k_rsgrid.o input_cp2k_restarts_util.o input_cp2k_resp.o input_cp2k_read.o input_cp2k_qmmm.o input_cp2k_pwdft.o input_cp2k_properties_dft.o input_cp2k_poisson.o input_cp2k_nnp.o input_cp2k_negf.o input_cp2k_neb.o input_cp2k_mp2.o input_cp2k_motion_print.o input_cp2k_mm.o input_cp2k_mixed.o input_cp2k_ls.o input_cp2k_loc.o input_cp2k_kpoints.o input_cp2k_hfx.o input_cp2k_global.o input_cp2k_free_energy.o input_cp2k_force_eval.o input_cp2k_field.o input_cp2k_external.o input_cp2k_embed.o input_cp2k_eip.o input_cp2k_ec.o input_cp2k_distribution.o input_cp2k_dft.o input_cp2k_constraints.o input_cp2k_colvar.o input_cp2k_check.o input_cp2k_binary_restarts.o input_cp2k_atprop.o input_cp2k_atom.o input_cp2k_almo.o input_constants.o hirshfeld_types.o hirshfeld_methods.o hfx_types.o hfx_screening_methods.o hfx_ri.o hfx_pw_methods.o hfx_pair_list_methods.o hfx_load_balance_methods.o hfx_libint_interface.o hfx_helpers.o hfx_energy_potential.o hfx_derivatives.o hfx_compression_methods.o hfx_communication.o hfx_admm_utils.o header.o hartree_local_types.o hartree_local_methods.o grrm_utils.o group_dist_types.o graphcon.o global_types.o gle_system_types.o generic_os_integrals.o free_energy_types.o fp_types.o fp_methods.o force_fields_util.o force_fields_input.o force_fields_ext.o force_fields_all.o force_fields.o force_field_types.o force_env_utils.o force_env_types.o force_env_methods.o fist_pol_scf.o fist_nonbond_force.o fist_nonbond_env_types.o fist_neighbor_lists.o fist_neighbor_list_types.o fist_neighbor_list_control.o fist_main.o fist_intra_force.o fist_force.o fist_environment_types.o fist_environment.o fist_energy_types.o fist_efield_types.o fist_efield_methods.o fermi_utils.o farming_types.o farming_methods.o f77_interface.o external_potential_methods.o extended_system_types.o exclusion_types.o ewalds_multipole.o ewalds.o ewald_spline_util.o ewald_pw_types.o ewald_pw_methods.o ewald_methods_tb.o ewald_environment_types.o et_coupling_types.o et_coupling_proj.o et_coupling.o environment.o energy_corrections.o embed_types.o embed_main.o embed_environment.o eip_silicon.o eip_environment_types.o eip_environment.o efield_utils.o efield_tb_methods.o ec_environment.o ec_env_types.o ec_efield_local.o domain_submatrix_types.o domain_submatrix_methods.o dm_ls_scf_types.o dm_ls_scf_qs.o dm_ls_scf_methods.o dm_ls_scf_curvy.o dm_ls_scf_create.o dm_ls_scf.o dm_ls_chebyshev.o dkh_main.o distribution_methods.o distribution_2d_types.o dft_plus_u.o debug_os_integrals.o ct_types.o ct_methods.o csvr_system_utils.o csvr_system_types.o cryssym.o cp_symmetry.o cp_subsys_methods.o cp_realspace_grid_init.o cp_realspace_grid_cube.o cp_gemm_interface.o cp_external_control.o cp_eri_mme_interface.o cp_ddapc_util.o cp_ddapc_types.o cp_ddapc_methods.o cp_ddapc_forces.o cp_ddapc.o cp_dbcsr_output.o cp_dbcsr_operations.o cp_dbcsr_diag.o cp_dbcsr_cp2k_link.o cp_dbcsr_cholesky.o cp_control_utils.o cp_control_types.o cp2k_info.o cp2k_debug.o core_ppnl.o core_ppl.o core_ae.o constraint_vsite.o constraint_util.o constraint_fxd.o constraint_clv.o constraint_4x6.o constraint_3x3.o constraint.o commutator_rpnl.o commutator_rkinetic.o colvar_utils.o colvar_methods.o cell_methods.o bsse.o bse.o block_p_types.o beta_gamma_psi.o basis_set_output.o auto_basis.o atoms_input.o atomic_charges.o atom_xc.o atom_utils.o atom_upf.o atom_types.o atom_sgp.o atom_pseudo.o atom_output.o atom_optimization.o atom_operators.o atom_kind_orbitals.o atom_grb.o atom_fit.o atom_energy.o atom_electronic_structure.o atom_basis.o atom_admm_methods.o atom.o almo_scf_types.o almo_scf_qs.o almo_scf_optimizer.o almo_scf_methods.o almo_scf_lbfgs_types.o almo_scf_env_methods.o almo_scf_diis_types.o almo_scf.o al_system_types.o admm_utils.o admm_types.o admm_methods.o admm_dm_types.o admm_dm_methods.o sockets.o @@ -48452,10 +48487,10 @@ ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a rs_pw_interface.o pw_env_types.o gaussian_gridlevels.o cp_spline_utils.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:127: update target '/build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/dumpdcd.psmp' due to: dumpdcd.o /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kthermostat.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrarnoldi.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrx.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kshg_int.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2keri_mme.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kminimax.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2khfxbase.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kxc.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a -mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:25:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/dumpdcd.psmp dumpdcd.o -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2kmain -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kpw_env -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kfpga -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa +mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/dumpdcd.psmp dumpdcd.o -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2kmain -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kpw_env -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kfpga -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'xyz2dcd.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/xyz2dcd.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/xyz2dcd.F xyz2dcd.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:25:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/xyz2dcd.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xyz2dcd.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:52 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/xyz2dcd.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' xyz2dcd.F90 /build/reproducible-path/cp2k-8.1/src/motion/xyz2dcd.F:602:28: 602 | SUBROUTINE build_h_matrix(a, b, c, alpha, beta, gamma, h) @@ -48504,346 +48539,346 @@ | ^ Warning: 'atomic_displacement.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:123: update target '/build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/xyz2dcd.psmp' due to: xyz2dcd.o /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kthermostat.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrarnoldi.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrx.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kshg_int.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2keri_mme.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kminimax.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2khfxbase.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kxc.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a -mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:25:44 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/xyz2dcd.psmp xyz2dcd.o -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2kmain -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kpw_env -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kfpga -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optimize_basis.mod' due to: optimize_basis.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mscfg_methods.mod' due to: mscfg_methods.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_methods.mod' due to: pint_methods.o -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod fist_environment_types.mod cell_types.mod cp_para_types.mod pair_potential_types.mod molecule_kind_types.mod fist_nonbond_env_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod global_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod string_utilities.mod mathconstants.mod cp_files.mod kinds.mod physcon.mod cp_log_handling.mod base_hooks.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_types.F mc_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:25:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_types.mod' due to: mc_types.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod fist_environment_types.mod cell_types.mod cp_para_types.mod pair_potential_types.mod molecule_kind_types.mod fist_nonbond_env_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod global_types.mod atomic_kind_types.mod input_section_types.mod input_constants.mod string_utilities.mod mathconstants.mod cp_files.mod kinds.mod physcon.mod cp_log_handling.mod base_hooks.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod force_env_types.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_environment_types.F mc_environment_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:25:55 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_environment_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_environment_types.mod' due to: mc_environment_types.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod force_env_types.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_misc.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_misc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod force_env_types.mod base_hooks.mod mathconstants.mod cp_files.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_misc.F mc_misc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:25:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_misc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_misc.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_misc.mod' due to: mc_misc.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_misc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod force_env_types.mod base_hooks.mod mathconstants.mod cp_files.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_control.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod mc_types.mod parallel_rng_types.mod cell_types.mod cp_para_types.mod molecule_kind_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod global_types.mod atomic_kind_types.mod input_section_types.mod cp_files.mod kinds.mod f77_interface.mod physcon.mod message_passing.mod mc_misc.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_control.F mc_control.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:00 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_control.F90 -/build/reproducible-path/cp2k-8.1/src/motion/mc/mc_control.F:289:54: - - 289 | atom_symbols(iunit) = atom_names(iunit, 1) - | 1 -Warning: CHARACTER expression will be truncated in assignment (5/80) at (1) [-Wcharacter-truncation] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_control.mod' due to: mc_control.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_control.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod mc_types.mod parallel_rng_types.mod cell_types.mod cp_para_types.mod molecule_kind_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod global_types.mod atomic_kind_types.mod input_section_types.mod cp_files.mod kinds.mod f77_interface.mod physcon.mod message_passing.mod mc_misc.mod cp_log_handling.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_coordinates.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_coordinates.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod mc_types.mod cp_subsys_types.mod parallel_rng_types.mod particle_list_types.mod force_env_types.mod cell_types.mod force_env_methods.mod mathconstants.mod message_passing.mod base_hooks.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_coordinates.F mc_coordinates.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_coordinates.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_coordinates.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_coordinates.mod' due to: mc_coordinates.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_coordinates.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_types.mod mc_types.mod cp_subsys_types.mod parallel_rng_types.mod particle_list_types.mod force_env_types.mod cell_types.mod force_env_methods.mod mathconstants.mod message_passing.mod base_hooks.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_move_control.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_move_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod base_hooks.mod mathconstants.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_move_control.F mc_move_control.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_move_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_move_control.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_move_control.mod' due to: mc_move_control.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_move_control.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod base_hooks.mod mathconstants.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_ge_moves.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ge_moves.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod parallel_rng_types.mod cell_types.mod cp_para_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod input_section_types.mod input_constants.mod kinds.mod mc_coordinates.mod force_env_methods.mod mc_move_control.mod physcon.mod mc_control.mod message_passing.mod mc_misc.mod particle_methods.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ge_moves.F mc_ge_moves.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:08 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_ge_moves.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_ge_moves.F90 -/build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ge_moves.F:544:65: - - 544 | moves(molecule_type, insert_box)%moves%swap%attempts + 1 - | ^ -Warning: 'molecule_type' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ge_moves.F:1092:38: - - 1092 | DEALLOCATE (test_env_bias) - | ^ -Warning: 'test_env_bias.data' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_ge_moves.mod' due to: mc_ge_moves.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ge_moves.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod parallel_rng_types.mod cell_types.mod cp_para_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod input_section_types.mod input_constants.mod kinds.mod mc_coordinates.mod force_env_methods.mod mc_move_control.mod physcon.mod mc_control.mod message_passing.mod mc_misc.mod particle_methods.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_moves.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_moves.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod mc_types.mod parallel_rng_types.mod cell_types.mod molecule_kind_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod global_types.mod atomic_kind_types.mod mathconstants.mod kinds.mod mc_coordinates.mod force_env_methods.mod physcon.mod message_passing.mod md_run.mod cp_log_handling.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_moves.F mc_moves.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:14 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_moves.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_moves.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_moves.mod' due to: mc_moves.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_moves.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod mc_types.mod parallel_rng_types.mod cell_types.mod molecule_kind_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod global_types.mod atomic_kind_types.mod mathconstants.mod kinds.mod mc_coordinates.mod force_env_methods.mod physcon.mod message_passing.mod md_run.mod cp_log_handling.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_ensembles.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ensembles.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod parallel_rng_types.mod cell_types.mod cp_para_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod mc_environment_types.mod global_types.mod input_section_types.mod input_constants.mod mathconstants.mod cp_files.mod kinds.mod mc_coordinates.mod force_env_methods.mod mc_ge_moves.mod cp_external_control.mod mc_move_control.mod physcon.mod mc_control.mod message_passing.mod mc_moves.mod mc_misc.mod particle_methods.mod cp_log_handling.mod base_hooks.mod machine.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ensembles.F mc_ensembles.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:21 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_ensembles.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_ensembles.F90 -/build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ensembles.F:142:66: - - 142 | start_atom, start_atom_swap, start_atom_target, start_mol - | ^ -Warning: 'start_mol' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_ensembles.mod' due to: mc_ensembles.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ensembles.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod parallel_rng_types.mod cell_types.mod cp_para_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod mc_environment_types.mod global_types.mod input_section_types.mod input_constants.mod mathconstants.mod cp_files.mod kinds.mod mc_coordinates.mod force_env_methods.mod mc_ge_moves.mod cp_external_control.mod mc_move_control.mod physcon.mod mc_control.mod message_passing.mod mc_moves.mod mc_misc.mod particle_methods.mod cp_log_handling.mod base_hooks.mod machine.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_run.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_run.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_environment_types.mod global_types.mod cp_para_types.mod input_section_types.mod mc_types.mod parallel_rng_types.mod force_env_types.mod mc_control.mod cp_log_handling.mod base_hooks.mod mc_ensembles.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_run.F mc_run.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:28 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_run.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_run.F90 -/build/reproducible-path/cp2k-8.1/src/motion/mc/mc_run.F:171:36: - - 171 | ALLOCATE (force_env(1:nboxes)) - | ^ -Warning: 'nboxes' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_run.mod' due to: mc_run.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_run.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_environment_types.mod global_types.mod cp_para_types.mod input_section_types.mod mc_types.mod parallel_rng_types.mod force_env_types.mod mc_control.mod cp_log_handling.mod base_hooks.mod mc_ensembles.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'swarm_message.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/swarm_message.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod base_hooks.mod message_passing.mod kinds.mod cp_parser_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/swarm_message.F swarm_message.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:30 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_message.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_message.F90 -/build/reproducible-path/cp2k-8.1/src/swarm/swarm_message.F:254:41: - - 254 | curr_entry => curr_entry%next - | ^ -Warning: 'curr_entry' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'swarm_message.mod' due to: swarm_message.o /build/reproducible-path/cp2k-8.1/src/swarm/swarm_message.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod base_hooks.mod message_passing.mod kinds.mod cp_parser_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_worker.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_worker.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod mdctrl_types.mod input_section_types.mod cp_subsys_types.mod force_env_types.mod base_hooks.mod geo_opt.mod md_run.mod swarm_message.mod f77_interface.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_worker.F glbopt_worker.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:33 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_worker.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_worker.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_worker.mod' due to: glbopt_worker.o /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_worker.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod mdctrl_types.mod input_section_types.mod cp_subsys_types.mod force_env_types.mod base_hooks.mod geo_opt.mod md_run.mod swarm_message.mod f77_interface.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'swarm_worker.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/swarm_worker.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod input_constants.mod cp_log_handling.mod glbopt_worker.mod base_hooks.mod swarm_message.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/swarm_worker.F swarm_worker.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:35 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_worker.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_worker.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'swarm_worker.mod' due to: swarm_worker.o /build/reproducible-path/cp2k-8.1/src/swarm/swarm_worker.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod input_constants.mod cp_log_handling.mod glbopt_worker.mod base_hooks.mod swarm_message.mod cp_output_handling.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_history.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_history.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod kinds.mod base_hooks.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_history.F glbopt_history.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:37 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_history.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_history.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_history.mod' due to: glbopt_history.o /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_history.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod kinds.mod base_hooks.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_minhop.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_minhop.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod glbopt_history.mod swarm_message.mod bibliography.mod physcon.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_minhop.F glbopt_minhop.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:38 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_minhop.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_minhop.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_minhop.mod' due to: glbopt_minhop.o /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_minhop.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod glbopt_history.mod swarm_message.mod bibliography.mod physcon.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_mincrawl.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_mincrawl.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod parallel_rng_types.mod particle_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod glbopt_history.mod swarm_message.mod cp_output_handling.mod physcon.mod cp_units.mod kinds.mod particle_methods.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_mincrawl.F glbopt_mincrawl.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:40 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_mincrawl.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_mincrawl.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_mincrawl.mod' due to: glbopt_mincrawl.o /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_mincrawl.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod parallel_rng_types.mod particle_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod glbopt_history.mod swarm_message.mod cp_output_handling.mod physcon.mod cp_units.mod kinds.mod particle_methods.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_master.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_master.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod molecule_kind_types.mod exclusion_types.mod atomic_kind_types.mod input_section_types.mod colvar_types.mod molecule_types.mod input_constants.mod glbopt_minhop.mod kinds.mod glbopt_mincrawl.mod topology.mod cp_output_handling.mod particle_methods.mod cp_log_handling.mod base_hooks.mod swarm_message.mod cp_units.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_master.F glbopt_master.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:42 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_master.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_master.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_master.mod' due to: glbopt_master.o /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_master.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod molecule_kind_types.mod exclusion_types.mod atomic_kind_types.mod input_section_types.mod colvar_types.mod molecule_types.mod input_constants.mod glbopt_minhop.mod kinds.mod glbopt_mincrawl.mod topology.mod cp_output_handling.mod particle_methods.mod cp_log_handling.mod base_hooks.mod swarm_message.mod cp_units.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'swarm_master.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/swarm_master.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_external_control.mod swarm_message.mod glbopt_master.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/swarm_master.F swarm_master.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:43 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_master.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_master.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'swarm_master.mod' due to: swarm_master.o /build/reproducible-path/cp2k-8.1/src/swarm/swarm_master.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod cp_log_handling.mod base_hooks.mod cp_external_control.mod swarm_message.mod glbopt_master.mod cp_output_handling.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'swarm_mpi.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/swarm_mpi.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_iter_types.mod machine.mod cp_log_handling.mod message_passing.mod base_hooks.mod swarm_message.mod cp_files.mod cp_para_env.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/swarm_mpi.F swarm_mpi.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_mpi.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_mpi.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'swarm_mpi.mod' due to: swarm_mpi.o /build/reproducible-path/cp2k-8.1/src/swarm/swarm_mpi.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_iter_types.mod machine.mod cp_log_handling.mod message_passing.mod base_hooks.mod swarm_message.mod cp_files.mod cp_para_env.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'swarm.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/swarm.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod input_section_types.mod swarm_worker.mod cp_log_handling.mod base_hooks.mod swarm_master.mod swarm_message.mod swarm_mpi.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/swarm.F swarm.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:45 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'swarm.mod' due to: swarm.o /build/reproducible-path/cp2k-8.1/src/swarm/swarm.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 global_types.mod cp_para_types.mod input_section_types.mod swarm_worker.mod cp_log_handling.mod base_hooks.mod swarm_master.mod swarm_message.mod swarm_mpi.mod cp_output_handling.mod kinds.mod -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp2k_debug.mod' due to: cp2k_debug.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'vibrational_analysis.mod' due to: vibrational_analysis.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_methods.mod' due to: negf_methods.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'library_tests.mod' due to: library_tests.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt_module.mod' due to: qs_tddfpt_module.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'bsse.mod' due to: bsse.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom.mod' due to: atom.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'neb_methods.mod' due to: neb_methods.o -true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optimize_input.mod' due to: optimize_input.o +mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/xyz2dcd.psmp xyz2dcd.o -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2kmain -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kpw_env -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kfpga -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_input.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_input.F glbopt_input.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:53 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_input.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_input.mod' due to: glbopt_input.o /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod kinds.mod input_constants.mod cp_output_handling.mod string_utilities.mod bibliography.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tamc_run.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/tamc_run.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod mc_types.mod parallel_rng_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod virial_types.mod thermostat_types.mod qs_environment_types.mod md_environment_types.mod particle_types.mod reftraj_types.mod averages_types.mod thermal_region_types.mod molecule_kind_types.mod barostat_types.mod metadynamics_types.mod cp_subsys_types.mod simpar_types.mod force_env_types.mod free_energy_types.mod particle_list_types.mod distribution_1d_types.mod mc_environment_types.mod global_types.mod molecule_list_types.mod atomic_kind_types.mod input_section_types.mod colvar_types.mod md_ener_types.mod molecule_types.mod input_constants.mod string_utilities.mod thermal_region_utils.mod qs_scf_post_gpw.mod md_energies.mod constraint_fxd.mod input_cp2k_check.mod kinds.mod qmmm_util.mod virial_methods.mod force_env_methods.mod simpar_methods.mod cp_external_control.mod mc_move_control.mod cp_output_handling.mod physcon.mod thermostat_methods.mod md_run.mod reference_manager.mod wiener_process.mod bibliography.mod mc_misc.mod cp_log_handling.mod base_hooks.mod colvar_methods.mod reftraj_util.mod machine.mod cp_units.mod input_cp2k_restarts.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/tamc_run.F tamc_run.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:48 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/tamc_run.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tamc_run.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tamc_run.mod' due to: tamc_run.o /build/reproducible-path/cp2k-8.1/src/motion/mc/tamc_run.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 molecule_kind_list_types.mod mc_types.mod parallel_rng_types.mod cell_types.mod atomic_kind_list_types.mod cp_para_types.mod virial_types.mod thermostat_types.mod qs_environment_types.mod md_environment_types.mod particle_types.mod reftraj_types.mod averages_types.mod thermal_region_types.mod molecule_kind_types.mod barostat_types.mod metadynamics_types.mod cp_subsys_types.mod simpar_types.mod force_env_types.mod free_energy_types.mod particle_list_types.mod distribution_1d_types.mod mc_environment_types.mod global_types.mod molecule_list_types.mod atomic_kind_types.mod input_section_types.mod colvar_types.mod md_ener_types.mod molecule_types.mod input_constants.mod string_utilities.mod thermal_region_utils.mod qs_scf_post_gpw.mod md_energies.mod constraint_fxd.mod input_cp2k_check.mod kinds.mod qmmm_util.mod virial_methods.mod force_env_methods.mod simpar_methods.mod cp_external_control.mod mc_move_control.mod cp_output_handling.mod physcon.mod thermostat_methods.mod md_run.mod reference_manager.mod wiener_process.mod bibliography.mod mc_misc.mod cp_log_handling.mod base_hooks.mod colvar_methods.mod reftraj_util.mod machine.mod cp_units.mod input_cp2k_restarts.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'swarm_input.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/swarm_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_constants.mod cp_output_handling.mod string_utilities.mod glbopt_input.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/swarm_input.F swarm_input.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_input.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'swarm_input.mod' due to: swarm_input.o /build/reproducible-path/cp2k-8.1/src/swarm/swarm_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod input_constants.mod cp_output_handling.mod string_utilities.mod glbopt_input.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_constraints.mod' due to: input_cp2k_constraints.o +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_negf.mod' due to: input_cp2k_negf.o true /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_stati.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_stati.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_stati.F tmc_stati.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_stati.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_stati.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_stati.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_stati.F90 /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_stati.mod' due to: tmc_stati.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_stati.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_tmc.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/input_cp2k_tmc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_mm.mod base_hooks.mod bibliography.mod kinds.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_tmc.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/input_cp2k_tmc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod tmc_stati.mod kinds.mod base_hooks.mod bibliography.mod input_cp2k_mm.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/input_cp2k_tmc.F input_cp2k_tmc.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:56 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/input_cp2k_tmc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_tmc.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_tmc.mod' due to: input_cp2k_tmc.o /build/reproducible-path/cp2k-8.1/src/tmc/input_cp2k_tmc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_mm.mod base_hooks.mod bibliography.mod kinds.mod tmc_stati.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:54 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/input_cp2k_tmc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_tmc.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_tmc.mod' due to: input_cp2k_tmc.o /build/reproducible-path/cp2k-8.1/src/tmc/input_cp2k_tmc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_section_types.mod input_keyword_types.mod tmc_stati.mod kinds.mod base_hooks.mod bibliography.mod input_cp2k_mm.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_motion.o' due to: /build/reproducible-path/cp2k-8.1/src/start/input_cp2k_motion.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_neb.mod input_constants.mod input_cp2k_motion_print.mod string_utilities.mod input_cp2k_free_energy.mod base_hooks.mod input_cp2k_constraints.mod input_cp2k_thermostats.mod input_cp2k_md.mod input_cp2k_subsys.mod bibliography.mod cp_output_handling.mod input_cp2k_tmc.mod cp_units.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/start/input_cp2k_motion.F input_cp2k_motion.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:26:57 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/input_cp2k_motion.F\"" -I'/build/reproducible-path/cp2k-8.1/src/start/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_motion.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_motion.mod' due to: input_cp2k_motion.o /build/reproducible-path/cp2k-8.1/src/start/input_cp2k_motion.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_cp2k_neb.mod input_constants.mod input_cp2k_motion_print.mod string_utilities.mod input_cp2k_free_energy.mod base_hooks.mod input_cp2k_constraints.mod input_cp2k_thermostats.mod input_cp2k_md.mod input_cp2k_subsys.mod bibliography.mod cp_output_handling.mod input_cp2k_tmc.mod cp_units.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_constraints.mod' due to: input_cp2k_constraints.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_input.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod kinds.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_input.F glbopt_input.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:01 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_input.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_input.mod' due to: glbopt_input.o /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod bibliography.mod cp_output_handling.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k_motion.o' due to: /build/reproducible-path/cp2k-8.1/src/start/input_cp2k_motion.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod input_cp2k_tmc.mod kinds.mod base_hooks.mod input_constants.mod input_cp2k_thermostats.mod cp_output_handling.mod input_cp2k_subsys.mod string_utilities.mod input_cp2k_free_energy.mod input_cp2k_motion_print.mod input_cp2k_md.mod input_cp2k_neb.mod input_cp2k_constraints.mod bibliography.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/start/input_cp2k_motion.F input_cp2k_motion.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:55 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/input_cp2k_motion.F\"" -I'/build/reproducible-path/cp2k-8.1/src/start/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k_motion.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_motion.mod' due to: input_cp2k_motion.o /build/reproducible-path/cp2k-8.1/src/start/input_cp2k_motion.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod input_val_types.mod input_keyword_types.mod input_cp2k_tmc.mod kinds.mod base_hooks.mod input_constants.mod input_cp2k_thermostats.mod cp_output_handling.mod input_cp2k_subsys.mod string_utilities.mod input_cp2k_free_energy.mod input_cp2k_motion_print.mod input_cp2k_md.mod input_cp2k_neb.mod input_cp2k_constraints.mod bibliography.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'swarm_input.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/swarm_input.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod glbopt_input.mod cp_output_handling.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/swarm_input.F swarm_input.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_input.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_input.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'swarm_input.mod' due to: swarm_input.o /build/reproducible-path/cp2k-8.1/src/swarm/swarm_input.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod string_utilities.mod base_hooks.mod glbopt_input.mod cp_output_handling.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_vib.mod' due to: input_cp2k_vib.o true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_optimize_input.mod' due to: input_optimize_input.o true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_vib.mod' due to: input_cp2k_vib.o +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_atom.mod' due to: input_cp2k_atom.o true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_optimize_basis.mod' due to: input_optimize_basis.o true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_negf.mod' due to: input_cp2k_negf.o +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k.o' due to: /build/reproducible-path/cp2k-8.1/src/start/input_cp2k.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod swarm_input.mod kinds.mod pw_grids.mod cp_output_handling.mod input_cp2k_rsgrid.mod string_utilities.mod cp_eri_mme_interface.mod input_cp2k_global.mod input_cp2k_negf.mod input_cp2k_force_eval.mod base_hooks.mod input_cp2k_motion.mod shg_integrals_test.mod input_cp2k_vib.mod input_optimize_input.mod input_constants.mod input_cp2k_atom.mod input_optimize_basis.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/start/input_cp2k.F input_cp2k.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:21:58 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/input_cp2k.F\"" -I'/build/reproducible-path/cp2k-8.1/src/start/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k.mod' due to: input_cp2k.o /build/reproducible-path/cp2k-8.1/src/start/input_cp2k.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod input_val_types.mod input_section_types.mod swarm_input.mod kinds.mod pw_grids.mod cp_output_handling.mod input_cp2k_rsgrid.mod string_utilities.mod cp_eri_mme_interface.mod input_cp2k_global.mod input_cp2k_negf.mod input_cp2k_force_eval.mod base_hooks.mod input_cp2k_motion.mod shg_integrals_test.mod input_cp2k_vib.mod input_optimize_input.mod input_constants.mod input_cp2k_atom.mod input_optimize_basis.mod true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k_atom.mod' due to: input_cp2k_atom.o +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'neb_methods.mod' due to: neb_methods.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'input_cp2k.o' due to: /build/reproducible-path/cp2k-8.1/src/start/input_cp2k.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod input_cp2k_motion.mod string_utilities.mod pw_grids.mod swarm_input.mod kinds.mod input_optimize_input.mod input_cp2k_vib.mod cp_output_handling.mod input_optimize_basis.mod input_cp2k_negf.mod input_cp2k_rsgrid.mod shg_integrals_test.mod input_cp2k_force_eval.mod base_hooks.mod input_cp2k_global.mod input_cp2k_atom.mod cp_eri_mme_interface.mod -/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/start/input_cp2k.F input_cp2k.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:02 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/input_cp2k.F\"" -I'/build/reproducible-path/cp2k-8.1/src/start/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' input_cp2k.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'input_cp2k.mod' due to: input_cp2k.o /build/reproducible-path/cp2k-8.1/src/start/input_cp2k.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_val_types.mod input_keyword_types.mod input_section_types.mod input_constants.mod input_cp2k_motion.mod string_utilities.mod pw_grids.mod swarm_input.mod kinds.mod input_optimize_input.mod input_cp2k_vib.mod cp_output_handling.mod input_optimize_basis.mod input_cp2k_negf.mod input_cp2k_rsgrid.mod shg_integrals_test.mod input_cp2k_force_eval.mod base_hooks.mod input_cp2k_global.mod input_cp2k_atom.mod cp_eri_mme_interface.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'qs_tddfpt_module.mod' due to: qs_tddfpt_module.o +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'library_tests.mod' due to: library_tests.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_tree_types.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'vibrational_analysis.mod' due to: vibrational_analysis.o +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'atom.mod' due to: atom.o +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'farming_methods.mod' due to: farming_methods.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_tree_types.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_types.F tmc_tree_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:04 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_tree_types.mod' due to: tmc_tree_types.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_tree_types.mod' due to: tmc_tree_types.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_move_types.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_move_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_move_types.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_move_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_move_types.F tmc_move_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_move_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_move_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_move_types.mod' due to: tmc_move_types.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_move_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 kinds.mod base_hooks.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:00 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_move_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_move_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_move_types.mod' due to: tmc_move_types.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_move_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod kinds.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_types.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod cp_para_types.mod parallel_rng_types.mod cell_types.mod tmc_move_types.mod base_hooks.mod cp_para_env.mod kinds.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_types.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod tmc_tree_types.mod cell_types.mod tmc_move_types.mod tmc_stati.mod kinds.mod cp_para_env.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_types.F tmc_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_types.mod' due to: tmc_types.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod cp_para_types.mod parallel_rng_types.mod cell_types.mod tmc_move_types.mod base_hooks.mod cp_para_env.mod kinds.mod tmc_stati.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_types.mod' due to: tmc_types.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod parallel_rng_types.mod tmc_tree_types.mod cell_types.mod tmc_move_types.mod tmc_stati.mod kinds.mod cp_para_env.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_analysis_types.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_analysis_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod cell_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_analysis_types.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_analysis_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod cell_types.mod kinds.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_analysis_types.F tmc_analysis_types.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:05 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_analysis_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_analysis_types.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_analysis_types.mod' due to: tmc_analysis_types.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_analysis_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod cell_types.mod base_hooks.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:01 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_analysis_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_analysis_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_analysis_types.mod' due to: tmc_analysis_types.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_analysis_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod cell_types.mod kinds.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_calculations.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_calculations.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod parallel_rng_types.mod cell_types.mod tmc_move_types.mod cp_log_handling.mod mathconstants.mod base_hooks.mod f77_interface.mod physcon.mod kinds.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_calculations.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_calculations.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod tmc_types.mod tmc_tree_types.mod cell_types.mod tmc_move_types.mod tmc_stati.mod mathconstants.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_calculations.F tmc_calculations.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:06 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_calculations.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_calculations.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_calculations.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_calculations.F90 /build/reproducible-path/cp2k-8.1/src/tmc/tmc_calculations.F:134:31: 134 | conf%potential = e_pot | ^ Warning: 'e_pot' may be used uninitialized in this function [-Wmaybe-uninitialized] /build/reproducible-path/cp2k-8.1/src/tmc/tmc_calculations.F:134:31: Warning: 'e_pot' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_calculations.mod' due to: tmc_calculations.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_calculations.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod parallel_rng_types.mod cell_types.mod tmc_move_types.mod cp_log_handling.mod mathconstants.mod base_hooks.mod f77_interface.mod physcon.mod kinds.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_calculations.mod' due to: tmc_calculations.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_calculations.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod tmc_types.mod tmc_tree_types.mod cell_types.mod tmc_move_types.mod tmc_stati.mod mathconstants.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_file_io.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_file_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod tmc_analysis_types.mod tmc_move_types.mod cp_log_handling.mod base_hooks.mod cp_files.mod physcon.mod tmc_calculations.mod kinds.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_file_io.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_file_io.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_analysis_types.mod tmc_tree_types.mod tmc_move_types.mod tmc_stati.mod cp_log_handling.mod kinds.mod cp_files.mod tmc_calculations.mod physcon.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_file_io.F tmc_file_io.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:07 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_file_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_file_io.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_file_io.mod' due to: tmc_file_io.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_file_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod tmc_analysis_types.mod tmc_move_types.mod cp_log_handling.mod base_hooks.mod cp_files.mod physcon.mod tmc_calculations.mod kinds.mod tmc_stati.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:03 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_file_io.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_file_io.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_file_io.mod' due to: tmc_file_io.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_file_io.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_analysis_types.mod tmc_tree_types.mod tmc_move_types.mod tmc_stati.mod cp_log_handling.mod kinds.mod cp_files.mod tmc_calculations.mod physcon.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_dot_tree.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_dot_tree.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod tmc_move_types.mod cp_log_handling.mod base_hooks.mod tmc_file_io.mod cp_files.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_dot_tree.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_dot_tree.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_move_types.mod tmc_types.mod tmc_tree_types.mod cp_log_handling.mod cp_files.mod tmc_file_io.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_dot_tree.F tmc_dot_tree.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:10 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_dot_tree.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_dot_tree.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_dot_tree.mod' due to: tmc_dot_tree.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_dot_tree.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod tmc_move_types.mod cp_log_handling.mod base_hooks.mod tmc_file_io.mod cp_files.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:05 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_dot_tree.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_dot_tree.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_dot_tree.mod' due to: tmc_dot_tree.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_dot_tree.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_move_types.mod tmc_types.mod tmc_tree_types.mod cp_log_handling.mod cp_files.mod tmc_file_io.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_cancelation.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_cancelation.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod base_hooks.mod cp_log_handling.mod tmc_dot_tree.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_cancelation.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_cancelation.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod cp_log_handling.mod tmc_dot_tree.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_cancelation.F tmc_cancelation.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_cancelation.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_cancelation.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_cancelation.mod' due to: tmc_cancelation.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_cancelation.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod base_hooks.mod cp_log_handling.mod tmc_dot_tree.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:06 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_cancelation.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_cancelation.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_cancelation.mod' due to: tmc_cancelation.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_cancelation.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod cp_log_handling.mod tmc_dot_tree.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_tree_references.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_references.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod tmc_cancelation.mod base_hooks.mod cp_log_handling.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_tree_references.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_references.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod cp_log_handling.mod tmc_cancelation.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_references.F tmc_tree_references.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:12 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_references.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_references.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_tree_references.mod' due to: tmc_tree_references.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_references.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod tmc_cancelation.mod base_hooks.mod cp_log_handling.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:07 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_references.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_references.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_tree_references.mod' due to: tmc_tree_references.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_references.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod cp_log_handling.mod tmc_cancelation.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_tree_search.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_search.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod cp_log_handling.mod base_hooks.mod tmc_tree_references.mod kinds.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_tree_search.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_search.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod tmc_stati.mod cp_log_handling.mod kinds.mod tmc_tree_references.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_search.F tmc_tree_search.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:13 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_search.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_search.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_tree_search.mod' due to: tmc_tree_search.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_search.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod cp_log_handling.mod base_hooks.mod tmc_tree_references.mod kinds.mod tmc_stati.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_search.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_search.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_tree_search.mod' due to: tmc_tree_search.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_search.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod tmc_stati.mod cp_log_handling.mod kinds.mod tmc_tree_references.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_move_handle.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_move_handle.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod input_section_types.mod tmc_types.mod tmc_move_types.mod string_utilities.mod cp_log_handling.mod mathconstants.mod base_hooks.mod physcon.mod kinds.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_move_handle.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_move_handle.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod tmc_move_types.mod input_section_types.mod tmc_stati.mod mathconstants.mod cp_log_handling.mod kinds.mod physcon.mod string_utilities.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_move_handle.F tmc_move_handle.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_move_handle.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_move_handle.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:10 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_move_handle.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_move_handle.F90 /build/reproducible-path/cp2k-8.1/src/tmc/tmc_move_handle.F:298:16: 298 | IF (move_types%mv_weight(ind) .GT. 0.0) THEN | ^ Warning: 'ind' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_move_handle.mod' due to: tmc_move_handle.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_move_handle.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod input_section_types.mod tmc_types.mod tmc_move_types.mod string_utilities.mod cp_log_handling.mod mathconstants.mod base_hooks.mod physcon.mod kinds.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_move_handle.mod' due to: tmc_move_handle.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_move_handle.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_tree_types.mod tmc_move_types.mod input_section_types.mod tmc_stati.mod mathconstants.mod cp_log_handling.mod kinds.mod physcon.mod string_utilities.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_moves.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_moves.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod parallel_rng_types.mod cell_types.mod tmc_move_types.mod mathlib.mod cp_log_handling.mod mathconstants.mod base_hooks.mod physcon.mod tmc_calculations.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_moves.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_moves.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod tmc_types.mod tmc_tree_types.mod cell_types.mod tmc_move_types.mod mathlib.mod mathconstants.mod cp_log_handling.mod kinds.mod tmc_calculations.mod physcon.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_moves.F tmc_moves.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:18 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_moves.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_moves.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_moves.mod' due to: tmc_moves.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_moves.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod parallel_rng_types.mod cell_types.mod tmc_move_types.mod mathlib.mod cp_log_handling.mod mathconstants.mod base_hooks.mod physcon.mod tmc_calculations.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:12 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_moves.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_moves.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_moves.mod' due to: tmc_moves.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_moves.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod tmc_types.mod tmc_tree_types.mod cell_types.mod tmc_move_types.mod mathlib.mod mathconstants.mod cp_log_handling.mod kinds.mod tmc_calculations.mod physcon.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_tree_build.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_build.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod tmc_move_types.mod tmc_tree_search.mod cp_log_handling.mod base_hooks.mod tmc_move_handle.mod tmc_file_io.mod tmc_tree_references.mod tmc_moves.mod tmc_calculations.mod kinds.mod tmc_dot_tree.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_tree_build.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_build.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_move_types.mod tmc_types.mod tmc_tree_types.mod tmc_move_handle.mod tmc_stati.mod tmc_moves.mod cp_log_handling.mod kinds.mod tmc_calculations.mod tmc_tree_search.mod tmc_tree_references.mod tmc_dot_tree.mod tmc_file_io.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_build.F tmc_tree_build.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_build.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_build.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_tree_build.mod' due to: tmc_tree_build.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_build.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod tmc_move_types.mod tmc_tree_search.mod cp_log_handling.mod base_hooks.mod tmc_move_handle.mod tmc_file_io.mod tmc_tree_references.mod tmc_moves.mod tmc_calculations.mod kinds.mod tmc_dot_tree.mod tmc_stati.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_build.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_build.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_tree_build.mod' due to: tmc_tree_build.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_build.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_move_types.mod tmc_types.mod tmc_tree_types.mod tmc_move_handle.mod tmc_stati.mod tmc_moves.mod cp_log_handling.mod kinds.mod tmc_calculations.mod tmc_tree_search.mod tmc_tree_references.mod tmc_dot_tree.mod tmc_file_io.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_tree_acceptance.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_acceptance.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod tmc_move_types.mod tmc_tree_search.mod tmc_tree_build.mod cp_log_handling.mod base_hooks.mod tmc_move_handle.mod tmc_file_io.mod physcon.mod tmc_calculations.mod kinds.mod tmc_dot_tree.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_tree_acceptance.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_acceptance.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_move_types.mod tmc_types.mod tmc_tree_types.mod tmc_tree_build.mod tmc_move_handle.mod tmc_stati.mod cp_log_handling.mod kinds.mod tmc_calculations.mod tmc_tree_search.mod physcon.mod tmc_dot_tree.mod tmc_file_io.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_acceptance.F tmc_tree_acceptance.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:25 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_acceptance.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_acceptance.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_tree_acceptance.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_tree_acceptance.F90 /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_acceptance.F:396:10: 396 | IF (parent_ready) THEN | ^ Warning: 'parent_ready' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_tree_acceptance.mod' due to: tmc_tree_acceptance.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_acceptance.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_types.mod tmc_move_types.mod tmc_tree_search.mod tmc_tree_build.mod cp_log_handling.mod base_hooks.mod tmc_move_handle.mod tmc_file_io.mod physcon.mod tmc_calculations.mod kinds.mod tmc_dot_tree.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_tree_acceptance.mod' due to: tmc_tree_acceptance.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_tree_acceptance.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_move_types.mod tmc_types.mod tmc_tree_types.mod tmc_tree_build.mod tmc_move_handle.mod tmc_stati.mod cp_log_handling.mod kinds.mod tmc_calculations.mod tmc_tree_search.mod physcon.mod tmc_dot_tree.mod tmc_file_io.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_messages.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_messages.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod cp_para_types.mod tmc_types.mod tmc_tree_build.mod cp_log_handling.mod message_passing.mod base_hooks.mod kinds.mod tmc_move_handle.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_messages.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_messages.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod tmc_types.mod tmc_tree_types.mod tmc_tree_build.mod message_passing.mod tmc_stati.mod cp_log_handling.mod kinds.mod tmc_move_handle.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_messages.F tmc_messages.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:29 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_messages.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_messages.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_messages.mod' due to: tmc_messages.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_messages.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod cp_para_types.mod tmc_types.mod tmc_tree_build.mod cp_log_handling.mod message_passing.mod base_hooks.mod kinds.mod tmc_move_handle.mod tmc_stati.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_messages.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_messages.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_messages.mod' due to: tmc_messages.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_messages.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod tmc_types.mod tmc_tree_types.mod tmc_tree_build.mod message_passing.mod tmc_stati.mod cp_log_handling.mod kinds.mod tmc_move_handle.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_master.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_master.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod cell_types.mod cp_para_types.mod tmc_types.mod global_types.mod machine.mod tmc_calculations.mod kinds.mod tmc_dot_tree.mod tmc_stati.mod cp_external_control.mod tmc_tree_acceptance.mod tmc_move_handle.mod tmc_tree_build.mod tmc_cancelation.mod tmc_tree_search.mod cp_log_handling.mod base_hooks.mod tmc_file_io.mod tmc_messages.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_master.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_master.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod global_types.mod tmc_types.mod tmc_tree_types.mod tmc_stati.mod cp_log_handling.mod kinds.mod cp_external_control.mod tmc_calculations.mod tmc_dot_tree.mod tmc_file_io.mod tmc_cancelation.mod tmc_tree_search.mod tmc_move_handle.mod machine.mod base_hooks.mod tmc_tree_build.mod tmc_tree_acceptance.mod tmc_messages.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_master.F tmc_master.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:34 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_master.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_master.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_master.mod' due to: tmc_master.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_master.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod cell_types.mod cp_para_types.mod tmc_types.mod global_types.mod machine.mod tmc_calculations.mod kinds.mod tmc_dot_tree.mod tmc_stati.mod cp_external_control.mod tmc_tree_acceptance.mod tmc_move_handle.mod tmc_tree_build.mod tmc_cancelation.mod tmc_tree_search.mod cp_log_handling.mod base_hooks.mod tmc_file_io.mod tmc_messages.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:24 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_master.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_master.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_master.mod' due to: tmc_master.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_master.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cell_types.mod global_types.mod tmc_types.mod tmc_tree_types.mod tmc_stati.mod cp_log_handling.mod kinds.mod cp_external_control.mod tmc_calculations.mod tmc_dot_tree.mod tmc_file_io.mod tmc_cancelation.mod tmc_tree_search.mod tmc_move_handle.mod machine.mod base_hooks.mod tmc_tree_build.mod tmc_tree_acceptance.mod tmc_messages.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_analysis.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_analysis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod input_section_types.mod tmc_types.mod tmc_analysis_types.mod cell_types.mod tmc_tree_build.mod mathlib.mod cp_log_handling.mod mathconstants.mod cp_files.mod base_hooks.mod force_fields_input.mod tmc_file_io.mod physcon.mod tmc_calculations.mod kinds.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_analysis.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_analysis.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_analysis_types.mod tmc_tree_types.mod cell_types.mod input_section_types.mod tmc_tree_build.mod mathlib.mod tmc_stati.mod mathconstants.mod cp_log_handling.mod cp_files.mod kinds.mod tmc_calculations.mod physcon.mod force_fields_input.mod tmc_file_io.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_analysis.F tmc_analysis.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:39 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_analysis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_analysis.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_analysis.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_analysis.F90 /build/reproducible-path/cp2k-8.1/src/tmc/tmc_analysis.F:1131:89: 1131 | REAL(KIND=dp) :: aver_box_scale(3), vol, voldr | ^ Warning: 'voldr' may be used uninitialized in this function [-Wmaybe-uninitialized] -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_analysis.mod' due to: tmc_analysis.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_analysis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod input_section_types.mod tmc_types.mod tmc_analysis_types.mod cell_types.mod tmc_tree_build.mod mathlib.mod cp_log_handling.mod mathconstants.mod cp_files.mod base_hooks.mod force_fields_input.mod tmc_file_io.mod physcon.mod tmc_calculations.mod kinds.mod tmc_stati.mod +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_analysis.mod' due to: tmc_analysis.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_analysis.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_types.mod tmc_analysis_types.mod tmc_tree_types.mod cell_types.mod input_section_types.mod tmc_tree_build.mod mathlib.mod tmc_stati.mod mathconstants.mod cp_log_handling.mod cp_files.mod kinds.mod tmc_calculations.mod physcon.mod force_fields_input.mod tmc_file_io.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_worker.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_worker.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_analysis_types.mod cell_types.mod tmc_move_types.mod cp_para_types.mod tmc_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod molecule_list_types.mod cp_result_types.mod tmc_calculations.mod cp_result_methods.mod kinds.mod tmc_stati.mod cp_external_control.mod f77_interface.mod tmc_tree_acceptance.mod tmc_move_handle.mod tmc_tree_build.mod tmc_analysis.mod cp_log_handling.mod base_hooks.mod tmc_messages.mod tmc_moves.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_worker.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_worker.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cp_result_types.mod tmc_analysis_types.mod cell_types.mod force_env_types.mod particle_list_types.mod tmc_move_types.mod tmc_types.mod tmc_tree_types.mod molecule_list_types.mod tmc_stati.mod tmc_moves.mod cp_log_handling.mod kinds.mod f77_interface.mod cp_external_control.mod tmc_calculations.mod cp_result_methods.mod tmc_analysis.mod tmc_move_handle.mod base_hooks.mod tmc_tree_build.mod tmc_tree_acceptance.mod tmc_messages.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_worker.F tmc_worker.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:46 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_worker.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_worker.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_worker.mod' due to: tmc_worker.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_worker.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod tmc_analysis_types.mod cell_types.mod tmc_move_types.mod cp_para_types.mod tmc_types.mod cp_subsys_types.mod particle_list_types.mod force_env_types.mod molecule_list_types.mod cp_result_types.mod tmc_calculations.mod cp_result_methods.mod kinds.mod tmc_stati.mod cp_external_control.mod f77_interface.mod tmc_tree_acceptance.mod tmc_move_handle.mod tmc_tree_build.mod tmc_analysis.mod cp_log_handling.mod base_hooks.mod tmc_messages.mod tmc_moves.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:31 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_worker.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_worker.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_worker.mod' due to: tmc_worker.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_worker.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cp_result_types.mod tmc_analysis_types.mod cell_types.mod force_env_types.mod particle_list_types.mod tmc_move_types.mod tmc_types.mod tmc_tree_types.mod molecule_list_types.mod tmc_stati.mod tmc_moves.mod cp_log_handling.mod kinds.mod f77_interface.mod cp_external_control.mod tmc_calculations.mod cp_result_methods.mod tmc_analysis.mod tmc_move_handle.mod base_hooks.mod tmc_tree_build.mod tmc_tree_acceptance.mod tmc_messages.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_setup.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_setup.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod parallel_rng_types.mod tmc_analysis_types.mod cp_para_types.mod tmc_types.mod global_types.mod input_section_types.mod tmc_master.mod header.mod cp_files.mod kinds.mod tmc_stati.mod f77_interface.mod physcon.mod tmc_move_handle.mod tmc_tree_build.mod message_passing.mod environment.mod tmc_worker.mod bibliography.mod cp_para_env.mod tmc_analysis.mod cp_log_handling.mod base_hooks.mod tmc_file_io.mod machine.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_setup.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_setup.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod tmc_analysis_types.mod parallel_rng_types.mod global_types.mod tmc_types.mod tmc_tree_types.mod input_section_types.mod tmc_stati.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod bibliography.mod message_passing.mod tmc_master.mod cp_para_env.mod tmc_file_io.mod cp_files.mod tmc_worker.mod tmc_analysis.mod tmc_move_handle.mod machine.mod base_hooks.mod tmc_tree_build.mod header.mod environment.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_setup.F tmc_setup.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:54 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_setup.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_setup.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_setup.mod' due to: tmc_setup.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_setup.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 tmc_tree_types.mod parallel_rng_types.mod tmc_analysis_types.mod cp_para_types.mod tmc_types.mod global_types.mod input_section_types.mod tmc_master.mod header.mod cp_files.mod kinds.mod tmc_stati.mod f77_interface.mod physcon.mod tmc_move_handle.mod tmc_tree_build.mod message_passing.mod environment.mod tmc_worker.mod bibliography.mod cp_para_env.mod tmc_analysis.mod cp_log_handling.mod base_hooks.mod tmc_file_io.mod machine.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:34 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_setup.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_setup.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tmc_setup.mod' due to: tmc_setup.o /build/reproducible-path/cp2k-8.1/src/tmc/tmc_setup.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod tmc_analysis_types.mod parallel_rng_types.mod global_types.mod tmc_types.mod tmc_tree_types.mod input_section_types.mod tmc_stati.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod bibliography.mod message_passing.mod tmc_master.mod cp_para_env.mod tmc_file_io.mod cp_files.mod tmc_worker.mod tmc_analysis.mod tmc_move_handle.mod machine.mod base_hooks.mod tmc_tree_build.mod header.mod environment.mod true /build/reproducible-path/cp2k-8.1/Makefile:541: update target 'ipi_driver.mod' due to: ipi_driver.o true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cell_opt.mod' due to: cell_opt.o +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optimize_basis.mod' due to: optimize_basis.o true -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'farming_methods.mod' due to: farming_methods.o +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mscfg_methods.mod' due to: mscfg_methods.o +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'negf_methods.mod' due to: negf_methods.o +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp2k_debug.mod' due to: cp2k_debug.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod fist_environment_types.mod cell_types.mod force_env_types.mod particle_list_types.mod global_types.mod fist_nonbond_env_types.mod molecule_kind_list_types.mod atomic_kind_types.mod input_section_types.mod molecule_kind_types.mod pair_potential_types.mod cp_log_handling.mod kinds.mod physcon.mod string_utilities.mod cp_files.mod base_hooks.mod mathconstants.mod input_constants.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_types.F mc_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_types.mod' due to: mc_types.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod fist_environment_types.mod cell_types.mod force_env_types.mod particle_list_types.mod global_types.mod fist_nonbond_env_types.mod molecule_kind_list_types.mod atomic_kind_types.mod input_section_types.mod molecule_kind_types.mod pair_potential_types.mod cp_log_handling.mod kinds.mod physcon.mod string_utilities.mod cp_files.mod base_hooks.mod mathconstants.mod input_constants.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_environment_types.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_environment_types.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod force_env_types.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_environment_types.F mc_environment_types.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:44 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_environment_types.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_environment_types.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_environment_types.mod' due to: mc_environment_types.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_environment_types.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod force_env_types.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_misc.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_misc.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod force_env_types.mod mathconstants.mod kinds.mod cp_files.mod physcon.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_misc.F mc_misc.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:45 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_misc.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_misc.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_misc.mod' due to: mc_misc.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_misc.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod force_env_types.mod mathconstants.mod kinds.mod cp_files.mod physcon.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_control.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod particle_list_types.mod global_types.mod mc_types.mod molecule_kind_list_types.mod atomic_kind_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod message_passing.mod cp_files.mod mc_misc.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_control.F mc_control.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_control.F90 +/build/reproducible-path/cp2k-8.1/src/motion/mc/mc_control.F:289:54: + + 289 | atom_symbols(iunit) = atom_names(iunit, 1) + | 1 +Warning: CHARACTER expression will be truncated in assignment (5/80) at (1) [-Wcharacter-truncation] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_control.mod' due to: mc_control.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_control.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod particle_list_types.mod global_types.mod mc_types.mod molecule_kind_list_types.mod atomic_kind_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod f77_interface.mod physcon.mod message_passing.mod cp_files.mod mc_misc.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_coordinates.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_coordinates.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod cp_subsys_types.mod molecule_types.mod particle_list_types.mod cell_types.mod mc_types.mod force_env_types.mod message_passing.mod mathconstants.mod kinds.mod physcon.mod force_env_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_coordinates.F mc_coordinates.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:48 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_coordinates.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_coordinates.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_coordinates.mod' due to: mc_coordinates.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_coordinates.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod cp_subsys_types.mod molecule_types.mod particle_list_types.mod cell_types.mod mc_types.mod force_env_types.mod message_passing.mod mathconstants.mod kinds.mod physcon.mod force_env_methods.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_moves.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_moves.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod particle_list_types.mod global_types.mod mc_types.mod molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod physcon.mod message_passing.mod mc_coordinates.mod force_env_methods.mod base_hooks.mod mathconstants.mod md_run.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_moves.F mc_moves.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:51 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_moves.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_moves.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_moves.mod' due to: mc_moves.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_moves.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_subsys_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod particle_list_types.mod global_types.mod mc_types.mod molecule_kind_list_types.mod atomic_kind_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod physcon.mod message_passing.mod mc_coordinates.mod force_env_methods.mod base_hooks.mod mathconstants.mod md_run.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_move_control.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_move_control.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod mathconstants.mod kinds.mod physcon.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_move_control.F mc_move_control.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:56 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_move_control.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_move_control.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_move_control.mod' due to: mc_move_control.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_move_control.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 mc_types.mod mathconstants.mod kinds.mod physcon.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_ge_moves.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ge_moves.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod particle_list_types.mod mc_types.mod input_section_types.mod kinds.mod physcon.mod message_passing.mod mc_move_control.mod mc_coordinates.mod force_env_methods.mod mc_control.mod mc_misc.mod particle_methods.mod base_hooks.mod input_constants.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ge_moves.F mc_ge_moves.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:22:57 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_ge_moves.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_ge_moves.F90 +/build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ge_moves.F:544:65: + + 544 | moves(molecule_type, insert_box)%moves%swap%attempts + 1 + | ^ +Warning: 'molecule_type' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ge_moves.F:1092:38: + + 1092 | DEALLOCATE (test_env_bias) + | ^ +Warning: 'test_env_bias.data' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_ge_moves.mod' due to: mc_ge_moves.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ge_moves.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod particle_list_types.mod mc_types.mod input_section_types.mod kinds.mod physcon.mod message_passing.mod mc_move_control.mod mc_coordinates.mod force_env_methods.mod mc_control.mod mc_misc.mod particle_methods.mod base_hooks.mod input_constants.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_ensembles.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ensembles.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod particle_list_types.mod global_types.mod mc_types.mod input_section_types.mod mc_environment_types.mod cp_log_handling.mod kinds.mod physcon.mod mc_moves.mod message_passing.mod mc_move_control.mod cp_external_control.mod mc_ge_moves.mod mc_coordinates.mod force_env_methods.mod mc_control.mod cp_files.mod mc_misc.mod particle_methods.mod machine.mod base_hooks.mod mathconstants.mod input_constants.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ensembles.F mc_ensembles.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:02 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_ensembles.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_ensembles.F90 +/build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ensembles.F:142:66: + + 142 | start_atom, start_atom_swap, start_atom_target, start_mol + | ^ +Warning: 'start_mol' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_ensembles.mod' due to: mc_ensembles.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_ensembles.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod cell_types.mod force_env_types.mod parallel_rng_types.mod particle_list_types.mod global_types.mod mc_types.mod input_section_types.mod mc_environment_types.mod cp_log_handling.mod kinds.mod physcon.mod mc_moves.mod message_passing.mod mc_move_control.mod cp_external_control.mod mc_ge_moves.mod mc_coordinates.mod force_env_methods.mod mc_control.mod cp_files.mod mc_misc.mod particle_methods.mod machine.mod base_hooks.mod mathconstants.mod input_constants.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'mc_run.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_run.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mc_environment_types.mod parallel_rng_types.mod force_env_types.mod global_types.mod mc_types.mod input_section_types.mod mc_control.mod cp_log_handling.mod mc_ensembles.mod kinds.mod physcon.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_run.F mc_run.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:09 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/mc_run.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' mc_run.F90 +/build/reproducible-path/cp2k-8.1/src/motion/mc/mc_run.F:171:36: + + 171 | ALLOCATE (force_env(1:nboxes)) + | ^ +Warning: 'nboxes' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'mc_run.mod' due to: mc_run.o /build/reproducible-path/cp2k-8.1/src/motion/mc/mc_run.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod mc_environment_types.mod parallel_rng_types.mod force_env_types.mod global_types.mod mc_types.mod input_section_types.mod mc_control.mod cp_log_handling.mod mc_ensembles.mod kinds.mod physcon.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'swarm_message.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/swarm_message.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod message_passing.mod kinds.mod cp_parser_methods.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/swarm_message.F swarm_message.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:11 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_message.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_message.F90 +/build/reproducible-path/cp2k-8.1/src/swarm/swarm_message.F:254:41: + + 254 | curr_entry => curr_entry%next + | ^ +Warning: 'curr_entry' may be used uninitialized in this function [-Wmaybe-uninitialized] +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'swarm_message.mod' due to: swarm_message.o /build/reproducible-path/cp2k-8.1/src/swarm/swarm_message.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_parser_types.mod message_passing.mod kinds.mod cp_parser_methods.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_history.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_history.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_history.F glbopt_history.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_history.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_history.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_history.mod' due to: glbopt_history.o /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_history.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod base_hooks.mod kinds.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_minhop.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_minhop.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod kinds.mod glbopt_history.mod physcon.mod swarm_message.mod bibliography.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_minhop.F glbopt_minhop.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:13 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_minhop.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_minhop.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_minhop.mod' due to: glbopt_minhop.o /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_minhop.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod kinds.mod glbopt_history.mod physcon.mod swarm_message.mod bibliography.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_mincrawl.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_mincrawl.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod particle_types.mod input_section_types.mod cp_log_handling.mod glbopt_history.mod kinds.mod base_hooks.mod input_constants.mod particle_methods.mod cp_output_handling.mod physcon.mod swarm_message.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_mincrawl.F glbopt_mincrawl.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:14 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_mincrawl.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_mincrawl.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_mincrawl.mod' due to: glbopt_mincrawl.o /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_mincrawl.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 parallel_rng_types.mod particle_types.mod input_section_types.mod cp_log_handling.mod glbopt_history.mod kinds.mod base_hooks.mod input_constants.mod particle_methods.mod cp_output_handling.mod physcon.mod swarm_message.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_master.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_master.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod colvar_types.mod molecule_types.mod exclusion_types.mod atomic_kind_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod swarm_message.mod cp_output_handling.mod glbopt_minhop.mod topology.mod particle_methods.mod base_hooks.mod input_constants.mod glbopt_mincrawl.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_master.F glbopt_master.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:15 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_master.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_master.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_master.mod' due to: glbopt_master.o /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_master.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod particle_types.mod colvar_types.mod molecule_types.mod exclusion_types.mod atomic_kind_types.mod input_section_types.mod molecule_kind_types.mod cp_log_handling.mod kinds.mod swarm_message.mod cp_output_handling.mod glbopt_minhop.mod topology.mod particle_methods.mod base_hooks.mod input_constants.mod glbopt_mincrawl.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'swarm_master.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/swarm_master.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod global_types.mod cp_parser_types.mod input_section_types.mod cp_external_control.mod cp_log_handling.mod kinds.mod glbopt_master.mod input_constants.mod cp_output_handling.mod swarm_message.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/swarm_master.F swarm_master.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:16 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_master.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_master.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'swarm_master.mod' due to: swarm_master.o /build/reproducible-path/cp2k-8.1/src/swarm/swarm_master.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod global_types.mod cp_parser_types.mod input_section_types.mod cp_external_control.mod cp_log_handling.mod kinds.mod glbopt_master.mod input_constants.mod cp_output_handling.mod swarm_message.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'swarm_mpi.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/swarm_mpi.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_iter_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod machine.mod swarm_message.mod cp_para_env.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/swarm_mpi.F swarm_mpi.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:17 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_mpi.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_mpi.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'swarm_mpi.mod' due to: swarm_mpi.o /build/reproducible-path/cp2k-8.1/src/swarm/swarm_mpi.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_iter_types.mod message_passing.mod cp_log_handling.mod cp_files.mod kinds.mod machine.mod swarm_message.mod cp_para_env.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'glbopt_worker.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_worker.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod input_section_types.mod global_types.mod force_env_types.mod mdctrl_types.mod md_run.mod kinds.mod f77_interface.mod physcon.mod swarm_message.mod geo_opt.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_worker.F glbopt_worker.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:18 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/glbopt_worker.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' glbopt_worker.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'glbopt_worker.mod' due to: glbopt_worker.o /build/reproducible-path/cp2k-8.1/src/swarm/glbopt_worker.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod input_section_types.mod global_types.mod force_env_types.mod mdctrl_types.mod md_run.mod kinds.mod f77_interface.mod physcon.mod swarm_message.mod geo_opt.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'swarm_worker.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/swarm_worker.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_log_handling.mod kinds.mod input_constants.mod swarm_message.mod cp_output_handling.mod glbopt_worker.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/swarm_worker.F swarm_worker.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:19 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm_worker.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm_worker.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'swarm_worker.mod' due to: swarm_worker.o /build/reproducible-path/cp2k-8.1/src/swarm/swarm_worker.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp_log_handling.mod kinds.mod input_constants.mod swarm_message.mod cp_output_handling.mod glbopt_worker.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'swarm.o' due to: /build/reproducible-path/cp2k-8.1/src/swarm/swarm.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod global_types.mod input_section_types.mod swarm_master.mod cp_log_handling.mod kinds.mod swarm_mpi.mod swarm_message.mod cp_output_handling.mod swarm_worker.mod base_hooks.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/swarm/swarm.F swarm.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:20 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"swarm/swarm.F\"" -I'/build/reproducible-path/cp2k-8.1/src/swarm/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' swarm.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'swarm.mod' due to: swarm.o /build/reproducible-path/cp2k-8.1/src/swarm/swarm.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod global_types.mod input_section_types.mod swarm_master.mod cp_log_handling.mod kinds.mod swarm_mpi.mod swarm_message.mod cp_output_handling.mod swarm_worker.mod base_hooks.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'bsse.mod' due to: bsse.o +true +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tamc_run.o' due to: /build/reproducible-path/cp2k-8.1/src/motion/mc/tamc_run.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod averages_types.mod particle_types.mod cell_types.mod force_env_types.mod colvar_types.mod thermal_region_types.mod parallel_rng_types.mod molecule_types.mod barostat_types.mod particle_list_types.mod global_types.mod reftraj_types.mod thermostat_types.mod mc_types.mod md_ener_types.mod molecule_kind_list_types.mod atomic_kind_types.mod qs_environment_types.mod metadynamics_types.mod md_environment_types.mod free_energy_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod virial_types.mod mc_environment_types.mod molecule_list_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod wiener_process.mod thermal_region_utils.mod qmmm_util.mod bibliography.mod reference_manager.mod virial_methods.mod mc_move_control.mod cp_external_control.mod input_cp2k_restarts.mod force_env_methods.mod string_utilities.mod constraint_fxd.mod reftraj_util.mod mc_misc.mod thermostat_methods.mod machine.mod simpar_methods.mod base_hooks.mod md_run.mod input_cp2k_check.mod md_energies.mod input_constants.mod qs_scf_post_gpw.mod colvar_methods.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/motion/mc/tamc_run.F tamc_run.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:22 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"motion/mc/tamc_run.F\"" -I'/build/reproducible-path/cp2k-8.1/src/motion/mc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tamc_run.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'tamc_run.mod' due to: tamc_run.o /build/reproducible-path/cp2k-8.1/src/motion/mc/tamc_run.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod cp_subsys_types.mod averages_types.mod particle_types.mod cell_types.mod force_env_types.mod colvar_types.mod thermal_region_types.mod parallel_rng_types.mod molecule_types.mod barostat_types.mod particle_list_types.mod global_types.mod reftraj_types.mod thermostat_types.mod mc_types.mod md_ener_types.mod molecule_kind_list_types.mod atomic_kind_types.mod qs_environment_types.mod metadynamics_types.mod md_environment_types.mod free_energy_types.mod distribution_1d_types.mod input_section_types.mod molecule_kind_types.mod virial_types.mod mc_environment_types.mod molecule_list_types.mod simpar_types.mod atomic_kind_list_types.mod cp_log_handling.mod kinds.mod physcon.mod cp_output_handling.mod wiener_process.mod thermal_region_utils.mod qmmm_util.mod bibliography.mod reference_manager.mod virial_methods.mod mc_move_control.mod cp_external_control.mod input_cp2k_restarts.mod force_env_methods.mod string_utilities.mod constraint_fxd.mod reftraj_util.mod mc_misc.mod thermostat_methods.mod machine.mod simpar_methods.mod base_hooks.mod md_run.mod input_cp2k_check.mod md_energies.mod input_constants.mod qs_scf_post_gpw.mod colvar_methods.mod cp_units.mod +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'pint_methods.mod' due to: pint_methods.o +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'optimize_input.mod' due to: optimize_input.o +true +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cell_opt.mod' due to: cell_opt.o true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp2k_runs.o' due to: /build/reproducible-path/cp2k-8.1/src/start/cp2k_runs.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cp_para_types.mod farming_types.mod qs_environment_types.mod cp_control_types.mod force_env_types.mod global_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod input_cp2k_read.mod optimize_basis.mod string_utilities.mod cp2k_info.mod mscfg_methods.mod pint_methods.mod mc_run.mod cp_files.mod input_cp2k_check.mod kinds.mod swarm.mod cp2k_debug.mod qs_linres_module.mod rt_propagation.mod force_env_methods.mod vibrational_analysis.mod grid_api.mod sirius_interface.mod f77_interface.mod cp_output_handling.mod negf_methods.mod cp_parser_methods.mod library_tests.mod cuda_profiling.mod message_passing.mod qs_tddfpt_module.mod bsse.mod environment.mod md_run.mod reference_manager.mod atom.mod neb_methods.mod optimize_input.mod pw_fpga.mod cp_dbcsr_cp2k_link.mod tamc_run.mod bibliography.mod input_cp2k.mod cp_para_env.mod tmc_setup.mod ipi_driver.mod cp_log_handling.mod geo_opt.mod input_parsing.mod cell_opt.mod base_hooks.mod input_cp2k_global.mod pw_cuda.mod machine.mod farming_methods.mod cp_units.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp2k_runs.o' due to: /build/reproducible-path/cp2k-8.1/src/start/cp2k_runs.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod farming_types.mod cp_parser_types.mod force_env_types.mod global_types.mod input_keyword_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod f77_interface.mod neb_methods.mod input_cp2k.mod grid_api.mod pw_fpga.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod qs_linres_module.mod qs_tddfpt_module.mod bibliography.mod input_parsing.mod message_passing.mod reference_manager.mod rt_propagation.mod library_tests.mod vibrational_analysis.mod input_cp2k_read.mod atom.mod force_env_methods.mod sirius_interface.mod string_utilities.mod cp_para_env.mod farming_methods.mod cp2k_info.mod geo_opt.mod cp_files.mod tmc_setup.mod input_cp2k_global.mod ipi_driver.mod optimize_basis.mod machine.mod mscfg_methods.mod negf_methods.mod pw_cuda.mod base_hooks.mod cp2k_debug.mod mc_run.mod md_run.mod input_cp2k_check.mod swarm.mod bsse.mod tamc_run.mod pint_methods.mod input_constants.mod optimize_input.mod cuda_profiling.mod cell_opt.mod environment.mod cp_parser_methods.mod cp_units.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/start/cp2k_runs.F cp2k_runs.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:27:59 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/cp2k_runs.F\"" -I'/build/reproducible-path/cp2k-8.1/src/start/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k_runs.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp2k_runs.mod' due to: cp2k_runs.o /build/reproducible-path/cp2k-8.1/src/start/cp2k_runs.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_keyword_types.mod cp_para_types.mod farming_types.mod qs_environment_types.mod cp_control_types.mod force_env_types.mod global_types.mod input_section_types.mod cp_parser_types.mod input_constants.mod input_cp2k_read.mod optimize_basis.mod string_utilities.mod cp2k_info.mod mscfg_methods.mod pint_methods.mod mc_run.mod cp_files.mod input_cp2k_check.mod kinds.mod swarm.mod cp2k_debug.mod qs_linres_module.mod rt_propagation.mod force_env_methods.mod vibrational_analysis.mod grid_api.mod sirius_interface.mod f77_interface.mod cp_output_handling.mod negf_methods.mod cp_parser_methods.mod library_tests.mod cuda_profiling.mod message_passing.mod qs_tddfpt_module.mod bsse.mod environment.mod md_run.mod reference_manager.mod atom.mod neb_methods.mod optimize_input.mod pw_fpga.mod cp_dbcsr_cp2k_link.mod tamc_run.mod bibliography.mod input_cp2k.mod cp_para_env.mod tmc_setup.mod ipi_driver.mod cp_log_handling.mod geo_opt.mod input_parsing.mod cell_opt.mod base_hooks.mod input_cp2k_global.mod pw_cuda.mod machine.mod farming_methods.mod cp_units.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:27 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/cp2k_runs.F\"" -I'/build/reproducible-path/cp2k-8.1/src/start/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k_runs.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp2k_runs.mod' due to: cp2k_runs.o /build/reproducible-path/cp2k-8.1/src/start/cp2k_runs.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod farming_types.mod cp_parser_types.mod force_env_types.mod global_types.mod input_keyword_types.mod qs_environment_types.mod input_section_types.mod cp_control_types.mod cp_log_handling.mod kinds.mod f77_interface.mod neb_methods.mod input_cp2k.mod grid_api.mod pw_fpga.mod cp_output_handling.mod cp_dbcsr_cp2k_link.mod qs_linres_module.mod qs_tddfpt_module.mod bibliography.mod input_parsing.mod message_passing.mod reference_manager.mod rt_propagation.mod library_tests.mod vibrational_analysis.mod input_cp2k_read.mod atom.mod force_env_methods.mod sirius_interface.mod string_utilities.mod cp_para_env.mod farming_methods.mod cp2k_info.mod geo_opt.mod cp_files.mod tmc_setup.mod input_cp2k_global.mod ipi_driver.mod optimize_basis.mod machine.mod mscfg_methods.mod negf_methods.mod pw_cuda.mod base_hooks.mod cp2k_debug.mod mc_run.mod md_run.mod input_cp2k_check.mod swarm.mod bsse.mod tamc_run.mod pint_methods.mod input_constants.mod optimize_input.mod cuda_profiling.mod cell_opt.mod environment.mod cp_parser_methods.mod cp_units.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp2k_shell.o' due to: /build/reproducible-path/cp2k-8.1/src/start/cp2k_shell.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp2k_runs.mod input_constants.mod input_cp2k_read.mod string_utilities.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp2k_info.mod f77_interface.mod cp_files.mod machine.mod physcon.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp2k_shell.o' due to: /build/reproducible-path/cp2k-8.1/src/start/cp2k_shell.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod cp_files.mod f77_interface.mod input_cp2k_read.mod kinds.mod cp2k_runs.mod input_constants.mod physcon.mod string_utilities.mod cp2k_info.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/start/cp2k_shell.F cp2k_shell.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:28:11 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/cp2k_shell.F\"" -I'/build/reproducible-path/cp2k-8.1/src/start/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k_shell.F90 -/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp2k_shell.mod' due to: cp2k_shell.o /build/reproducible-path/cp2k-8.1/src/start/cp2k_shell.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod cp2k_runs.mod input_constants.mod input_cp2k_read.mod string_utilities.mod cp_log_handling.mod message_passing.mod base_hooks.mod cp2k_info.mod f77_interface.mod cp_files.mod machine.mod physcon.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:35 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/cp2k_shell.F\"" -I'/build/reproducible-path/cp2k-8.1/src/start/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k_shell.F90 +/build/reproducible-path/cp2k-8.1/Makefile:541: update target 'cp2k_shell.mod' due to: cp2k_shell.o /build/reproducible-path/cp2k-8.1/src/start/cp2k_shell.F /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 cp_para_types.mod input_section_types.mod message_passing.mod cp_log_handling.mod cp_files.mod f77_interface.mod input_cp2k_read.mod kinds.mod cp2k_runs.mod input_constants.mod physcon.mod string_utilities.mod cp2k_info.mod machine.mod base_hooks.mod true -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp2k.o' due to: /build/reproducible-path/cp2k-8.1/src/start/cp2k.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod machine.mod cp2k_runs.mod input_constants.mod base_hooks.mod cp2k_info.mod f77_interface.mod input_cp2k.mod cp2k_shell.mod kinds.mod +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'cp2k.o' due to: /build/reproducible-path/cp2k-8.1/src/start/cp2k.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 input_section_types.mod kinds.mod f77_interface.mod input_cp2k.mod cp2k_runs.mod input_constants.mod cp2k_shell.mod cp2k_info.mod machine.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/start/cp2k.F cp2k.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:28:15 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/cp2k.F\"" -I'/build/reproducible-path/cp2k-8.1/src/start/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k.F90 -/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'libcp2k.o' due to: /build/reproducible-path/cp2k-8.1/src/start/libcp2k.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_active_space_types.mod qs_mo_types.mod input_section_types.mod qs_environment_types.mod force_env_types.mod cp_fm_types.mod cp2k_runs.mod input_cp2k_read.mod base_hooks.mod cp2k_info.mod f77_interface.mod input_cp2k.mod kinds.mod +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:38 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/cp2k.F\"" -I'/build/reproducible-path/cp2k-8.1/src/start/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' cp2k.F90 +/build/reproducible-path/cp2k-8.1/Makefile:504: update target 'libcp2k.o' due to: /build/reproducible-path/cp2k-8.1/src/start/libcp2k.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 qs_environment_types.mod input_section_types.mod qs_active_space_types.mod qs_mo_types.mod cp_fm_types.mod force_env_types.mod kinds.mod f77_interface.mod input_cp2k_read.mod input_cp2k.mod cp2k_runs.mod cp2k_info.mod base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/start/libcp2k.F libcp2k.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:28:17 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/libcp2k.F\"" -I'/build/reproducible-path/cp2k-8.1/src/start/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' libcp2k.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:39 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"start/libcp2k.F\"" -I'/build/reproducible-path/cp2k-8.1/src/start/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' libcp2k.F90 /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kstart.a' due to: libcp2k.o input_cp2k_motion.o input_cp2k.o cp2k_shell.o cp2k_runs.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kstart.a" Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kstart.a @@ -48861,18 +48896,18 @@ ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kswarm.a /build/reproducible-path/cp2k-8.1/Makefile:504: update target 'tmc_utils.o' due to: /build/reproducible-path/cp2k-8.1/src/tmc/tmc_utils.F /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/src/base/base_uses.f90 base_hooks.mod /build/reproducible-path/cp2k-8.1/tools/build_utils/fypp -n /build/reproducible-path/cp2k-8.1/src/tmc/tmc_utils.F tmc_utils.F90 -mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:28:22 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_utils.F90 +mpif90 -c -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -D__SHORT_FILE__="\"tmc/tmc_utils.F\"" -I'/build/reproducible-path/cp2k-8.1/src/tmc/' -I'/build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr' tmc_utils.F90 /build/reproducible-path/cp2k-8.1/Makefile:519: update target '/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a' due to: tmc_worker.o tmc_utils.o tmc_types.o tmc_tree_types.o tmc_tree_search.o tmc_tree_references.o tmc_tree_build.o tmc_tree_acceptance.o tmc_stati.o tmc_setup.o tmc_moves.o tmc_move_types.o tmc_move_handle.o tmc_messages.o tmc_master.o tmc_file_io.o tmc_dot_tree.o tmc_cancelation.o tmc_calculations.o tmc_analysis_types.o tmc_analysis.o input_cp2k_tmc.o echo "Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a" Updating archive /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a ar -r /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a tmc_worker.o tmc_utils.o tmc_types.o tmc_tree_types.o tmc_tree_search.o tmc_tree_references.o tmc_tree_build.o tmc_tree_acceptance.o tmc_stati.o tmc_setup.o tmc_moves.o tmc_move_types.o tmc_move_handle.o tmc_messages.o tmc_master.o tmc_file_io.o tmc_dot_tree.o tmc_cancelation.o tmc_calculations.o tmc_analysis_types.o tmc_analysis.o input_cp2k_tmc.o ar: creating /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:119: update target '/build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/cp2k.psmp' due to: cp2k.o /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kstart.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmc.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kswarm.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kthermostat.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrarnoldi.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrx.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kshg_int.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2keri_mme.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kminimax.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2khfxbase.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kxc.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a -mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:28:23 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/cp2k.psmp cp2k.o -lcp2kstart -lcp2kmc -lcp2kswarm -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2ktmc -lcp2kmain -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kpw_env -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kfpga -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa +mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:42 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/cp2k.psmp cp2k.o -lcp2kstart -lcp2kmc -lcp2kswarm -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2ktmc -lcp2kmain -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kpw_env -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kfpga -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/reproducible-path/cp2k-8.1/Makefile:508: update target 'libcp2k_unittest.o' due to: /build/reproducible-path/cp2k-8.1/src/start/libcp2k_unittest.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_api.mod /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/exts/dbcsr/dbcsr_tensor_api.mod /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr/libdbcsr.a /build/reproducible-path/cp2k-8.1/src/start/libcp2k.h mpicc -c -g -Wall -O2 -fopenmp /build/reproducible-path/cp2k-8.1/src/start/libcp2k_unittest.c /build/reproducible-path/cp2k-8.1/obj/Linux-x86_64-gfortran/psmp/all.dep:143: update target '/build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/libcp2k_unittest.psmp' due to: libcp2k_unittest.o /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kstart.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmc.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kswarm.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmotion.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kthermostat.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kemd.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ktmc.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmain.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgrid.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridhybrid.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcpu.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridref.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kgridcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrarnoldi.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libdbcsrx.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kshg_int.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2keri_mme.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kminimax.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2khfxbase.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2ksubsys.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kxc.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kao.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw_env.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kinput.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kpw.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfft.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfpga.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kfm.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kcommon.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kmpiwrap.a /build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/libcp2kbase.a -mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Jan 7 05:28:36 -12 2024\"" -D__COMPILE_HOST="\"ionos11-amd64\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/libcp2k_unittest.psmp libcp2k_unittest.o -lcp2kstart -lcp2kmc -lcp2kswarm -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2ktmc -lcp2kmain -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kpw_env -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kfpga -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa +mpif90 -g -Wall -O2 -fopenmp -funroll-loops -ftree-vectorize -ffree-form -ffree-line-length-none -fallow-argument-mismatch -D__GFORTRAN -D__FFTSG -D__FFTW3 -D__LIBINT -D__LIBXC -D__SPGLIB -D__parallel -D__BLACS -D__SCALAPACK -D__ELPA=201605 -I/usr/include/elpa/modules/ -I/usr/include/elpa/elpa/ -I/usr/include -D__COMPILE_ARCH="\"Linux-x86_64-gfortran\"" -D__COMPILE_DATE="\"Sun Feb 9 16:23:46 +14 2025\"" -D__COMPILE_HOST="\"i-capture-the-hostname\"" -D__COMPILE_REVISION="\"git:0b61f2f\"" -D__DATA_DIR="\"/usr/share/cp2k\"" -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp -o /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/libcp2k_unittest.psmp libcp2k_unittest.o -lcp2kstart -lcp2kmc -lcp2kswarm -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2ktmc -lcp2kmain -lcp2kgrid -lcp2kgridhybrid -lcp2kgridcpu -lcp2kgridref -lcp2kgridcommon -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kpw_env -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kfpga -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/build/reproducible-path/cp2k-8.1/lib/Linux-x86_64-gfortran/psmp/exts/dbcsr -ldbcsr -llapack -lblas -lfftw3 -lfftw3_threads -lint2 -lstdc++ -lxc -lxcf03 -lsymspg $(pkg-config mpi-fort --libs) -lscalapack-openmpi -lscalapack-openmpi -lelpa /build/reproducible-path/cp2k-8.1/Makefile:237: update target '/build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/cp2k_shell.psmp' due to: /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/cp2k.psmp cd /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran; ln -sf cp2k.psmp cp2k_shell.psmp /build/reproducible-path/cp2k-8.1/Makefile:234: update target '/build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/cp2k.popt' due to: /build/reproducible-path/cp2k-8.1/exe/Linux-x86_64-gfortran/cp2k.psmp @@ -48935,12 +48970,12 @@ -restrictdir QS/regtest-ri-rpa ) ./do_regtest: line 620: ps: command not found *************************** testing started ****************************** - started on Sun Jan 7 05:29:12 -12 2024 + started on Sun Feb 9 16:23:58 +14 2025 configuration: Linux-x86_64-gfortran-psmp - regtesting location summary file: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/summary.txt - regtesting location error_summary file: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/error_summary - regtesting location memory_summary file: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/memory_summary - regtesting location output dir: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12 + regtesting location summary file: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/summary.txt + regtesting location error_summary file: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/error_summary + regtesting location memory_summary file: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/memory_summary + regtesting location output dir: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58 regtesting location last dir: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//LAST-Linux-x86_64-gfortran-psmp ---------------------------- Settings ------------------------------------ maxtasks = 2 @@ -49019,15 +49054,15 @@ DATA max data size unlimited unlimited bytes FSIZE max file size unlimited unlimited bytes LOCKS max number of file locks held unlimited unlimited locks -MEMLOCK max locked-in-memory address space 8459927552 8459927552 bytes +MEMLOCK max locked-in-memory address space 8425963520 8425963520 bytes MSGQUEUE max bytes in POSIX mqueues 819200 819200 bytes NICE max nice prio allowed to raise 0 0 NOFILE max number of open files 1024 1048576 files -NPROC max number of processes 192491 192491 processes +NPROC max number of processes 256983 256983 processes RSS max resident set size unlimited unlimited bytes RTPRIO max real-time priority 0 0 RTTIME timeout for real-time tasks unlimited unlimited microsecs -SIGPENDING max number of pending signals 192491 192491 signals +SIGPENDING max number of pending signals 256983 256983 signals STACK max stack size 8388608 unlimited bytes --------------------------- SELinux -------------------------------------- No SELinux installation found @@ -49037,38 +49072,38 @@ ------------------------ regtesting cp2k --------------------------------- ------------------------- dynamic libraries linked ----------------------- ldd /build/reproducible-path/cp2k-8.1/tools/regtesting/../..///exe/Linux-x86_64-gfortran/cp2k.psmp : - linux-vdso.so.1 (0x00007ffc2a1ab000) - liblapack.so.3 => /usr/lib/x86_64-linux-gnu/liblapack.so.3 (0x00007f856e7b7000) - libblas.so.3 => /usr/lib/x86_64-linux-gnu/libblas.so.3 (0x00007f856e747000) - libfftw3.so.3 => /usr/lib/x86_64-linux-gnu/libfftw3.so.3 (0x00007f856e53f000) - libfftw3_threads.so.3 => /usr/lib/x86_64-linux-gnu/libfftw3_threads.so.3 (0x00007f856e52f000) - libint2.so.2 => /usr/lib/x86_64-linux-gnu/libint2.so.2 (0x00007f856c29f000) - libxcf03.so.5 => /usr/lib/x86_64-linux-gnu/libxcf03.so.5 (0x00007f856c28f000) - libsymspg.so.1 => /usr/lib/x86_64-linux-gnu/libsymspg.so.1 (0x00007f856c23f000) - libmpi_mpifh.so.40 => /usr/lib/x86_64-linux-gnu/libmpi_mpifh.so.40 (0x00007f856c1d7000) - libscalapack-openmpi.so.2.1 => /usr/lib/x86_64-linux-gnu/libscalapack-openmpi.so.2.1 (0x00007f856bc2f000) - libelpa.so.15 => /usr/lib/x86_64-linux-gnu/libelpa.so.15 (0x00007f856bb4f000) - libgfortran.so.5 => /usr/lib/x86_64-linux-gnu/libgfortran.so.5 (0x00007f856b897000) - libm.so.6 => /lib/x86_64-linux-gnu/libm.so.6 (0x00007f856b74f000) - libmvec.so.1 => /lib/x86_64-linux-gnu/libmvec.so.1 (0x00007f856b71f000) - libgomp.so.1 => /usr/lib/x86_64-linux-gnu/libgomp.so.1 (0x00007f856b6df000) - libgcc_s.so.1 => /lib/x86_64-linux-gnu/libgcc_s.so.1 (0x00007f856b6bf000) - libpthread.so.0 => /lib/x86_64-linux-gnu/libpthread.so.0 (0x00007f856b697000) - libc.so.6 => /lib/x86_64-linux-gnu/libc.so.6 (0x00007f856b4bf000) - libstdc++.so.6 => /usr/lib/x86_64-linux-gnu/libstdc++.so.6 (0x00007f856b2ef000) - libxc.so.5 => /usr/lib/x86_64-linux-gnu/libxc.so.5 (0x00007f856ac9f000) - libmpi.so.40 => /usr/lib/x86_64-linux-gnu/libmpi.so.40 (0x00007f856ab6f000) - libopen-pal.so.40 => /usr/lib/x86_64-linux-gnu/libopen-pal.so.40 (0x00007f856aab7000) - libquadmath.so.0 => /usr/lib/x86_64-linux-gnu/libquadmath.so.0 (0x00007f856aa67000) - /lib64/ld-linux-x86-64.so.2 (0x00007f8571dbf000) - libdl.so.2 => /lib/x86_64-linux-gnu/libdl.so.2 (0x00007f856aa5f000) - libopen-rte.so.40 => /usr/lib/x86_64-linux-gnu/libopen-rte.so.40 (0x00007f856a99f000) - libhwloc.so.15 => /usr/lib/x86_64-linux-gnu/libhwloc.so.15 (0x00007f856a93f000) - libutil.so.1 => /lib/x86_64-linux-gnu/libutil.so.1 (0x00007f856a937000) - libevent_core-2.1.so.7 => /usr/lib/x86_64-linux-gnu/libevent_core-2.1.so.7 (0x00007f856a8f7000) - libevent_pthreads-2.1.so.7 => /usr/lib/x86_64-linux-gnu/libevent_pthreads-2.1.so.7 (0x00007f856a8ef000) - libz.so.1 => /lib/x86_64-linux-gnu/libz.so.1 (0x00007f856a8cf000) - libudev.so.1 => /usr/lib/x86_64-linux-gnu/libudev.so.1 (0x00007f856a8a7000) + linux-vdso.so.1 (0x00007ffefff65000) + liblapack.so.3 => /usr/lib/x86_64-linux-gnu/liblapack.so.3 (0x00007f0ab4141000) + libblas.so.3 => /usr/lib/x86_64-linux-gnu/libblas.so.3 (0x00007f0ab40d1000) + libfftw3.so.3 => /usr/lib/x86_64-linux-gnu/libfftw3.so.3 (0x00007f0ab3ec9000) + libfftw3_threads.so.3 => /usr/lib/x86_64-linux-gnu/libfftw3_threads.so.3 (0x00007f0ab3eb9000) + libint2.so.2 => /usr/lib/x86_64-linux-gnu/libint2.so.2 (0x00007f0ab1c29000) + libxcf03.so.5 => /usr/lib/x86_64-linux-gnu/libxcf03.so.5 (0x00007f0ab1c19000) + libsymspg.so.1 => /usr/lib/x86_64-linux-gnu/libsymspg.so.1 (0x00007f0ab1bc9000) + libmpi_mpifh.so.40 => /usr/lib/x86_64-linux-gnu/libmpi_mpifh.so.40 (0x00007f0ab1b61000) + libscalapack-openmpi.so.2.1 => /usr/lib/x86_64-linux-gnu/libscalapack-openmpi.so.2.1 (0x00007f0ab15b9000) + libelpa.so.15 => /usr/lib/x86_64-linux-gnu/libelpa.so.15 (0x00007f0ab14d9000) + libgfortran.so.5 => /usr/lib/x86_64-linux-gnu/libgfortran.so.5 (0x00007f0ab1221000) + libm.so.6 => /lib/x86_64-linux-gnu/libm.so.6 (0x00007f0ab10d9000) + libmvec.so.1 => /lib/x86_64-linux-gnu/libmvec.so.1 (0x00007f0ab10a9000) + libgomp.so.1 => /usr/lib/x86_64-linux-gnu/libgomp.so.1 (0x00007f0ab1069000) + libgcc_s.so.1 => /lib/x86_64-linux-gnu/libgcc_s.so.1 (0x00007f0ab1049000) + libpthread.so.0 => /lib/x86_64-linux-gnu/libpthread.so.0 (0x00007f0ab1021000) + libc.so.6 => /lib/x86_64-linux-gnu/libc.so.6 (0x00007f0ab0e49000) + libstdc++.so.6 => /usr/lib/x86_64-linux-gnu/libstdc++.so.6 (0x00007f0ab0c79000) + libxc.so.5 => /usr/lib/x86_64-linux-gnu/libxc.so.5 (0x00007f0ab0629000) + libmpi.so.40 => /usr/lib/x86_64-linux-gnu/libmpi.so.40 (0x00007f0ab04f9000) + libopen-pal.so.40 => /usr/lib/x86_64-linux-gnu/libopen-pal.so.40 (0x00007f0ab0441000) + libquadmath.so.0 => /usr/lib/x86_64-linux-gnu/libquadmath.so.0 (0x00007f0ab03f1000) + /lib64/ld-linux-x86-64.so.2 (0x00007f0ab7749000) + libdl.so.2 => /lib/x86_64-linux-gnu/libdl.so.2 (0x00007f0ab03e9000) + libopen-rte.so.40 => /usr/lib/x86_64-linux-gnu/libopen-rte.so.40 (0x00007f0ab0329000) + libhwloc.so.15 => /usr/lib/x86_64-linux-gnu/libhwloc.so.15 (0x00007f0ab02c9000) + libutil.so.1 => /lib/x86_64-linux-gnu/libutil.so.1 (0x00007f0ab02c1000) + libevent_core-2.1.so.7 => /usr/lib/x86_64-linux-gnu/libevent_core-2.1.so.7 (0x00007f0ab0281000) + libevent_pthreads-2.1.so.7 => /usr/lib/x86_64-linux-gnu/libevent_pthreads-2.1.so.7 (0x00007f0ab0279000) + libz.so.1 => /lib/x86_64-linux-gnu/libz.so.1 (0x00007f0ab0259000) + libudev.so.1 => /usr/lib/x86_64-linux-gnu/libudev.so.1 (0x00007f0ab0231000) -------------------------------------------------------------------------- Copying tests into working directory ... done! CP2K supports: cp2kflags: omp libint fftw3 libxc elpa parallel mpi3 scalapack spglib @@ -49086,7 +49121,7 @@ Skipping TMC/regtest_ana_post_proc : missing required feature : mpiranks>1 Skipping Fist/regtest-quip : missing required feature : quip Skipping Fist/regtest-plumed2 : missing required feature : plumed2 -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-mp2-grad (1 of 45) +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-mp2-grad (1 of 45) Running H2O_grad_mme.inp Running H2O_grad_gpw.inp Running H2_H2_no_freeHFX.inp @@ -49095,17 +49130,17 @@ Running CH_dyn_screen.inp Running MOM_MP2_geoopt.inp Running H2O_MD_mme.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-mp2-grad - H2O_grad_mme.inp -16.766973159454473 OK ( 55.46 sec) - H2O_grad_gpw.inp -16.990049885807579 OK ( 47.81 sec) - H2_H2_no_freeHFX.inp -2.307711033963836 OK ( 33.31 sec) - O2_dyn.inp -31.519148246527717 OK ( 39.85 sec) - O2_dyn_mme.inp 0.50585576 OK ( 33.26 sec) - CH_dyn_screen.inp -5.700371305121329 OK ( 22.70 sec) - MOM_MP2_geoopt.inp -13.969021706636104 OK ( 14.37 sec) - H2O_MD_mme.inp -17.056807611801165 OK ( 28.44 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-mp2-grad (1 of 45) done in 291.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-ri-rpa (2 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-mp2-grad + H2O_grad_mme.inp -16.766973159454590 OK ( 13.73 sec) + H2O_grad_gpw.inp -16.990049885806393 OK ( 12.45 sec) + H2_H2_no_freeHFX.inp -2.307711033963760 OK ( 7.56 sec) + O2_dyn.inp -31.519148246527717 OK ( 8.00 sec) + O2_dyn_mme.inp 0.50585576 OK ( 14.34 sec) + CH_dyn_screen.inp -5.700371305121165 OK ( 9.62 sec) + MOM_MP2_geoopt.inp -13.969021706601676 OK ( 10.01 sec) + H2O_MD_mme.inp -17.056807611801187 OK ( 22.45 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-mp2-grad (1 of 45) done in 104.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-ri-rpa (2 of 45) Running RI_RPA_H2O.inp Running RI_RPA_H2O_overlap_metric.inp Running RI_RPA_CH3.inp @@ -49117,20 +49152,20 @@ Running RI_RPA_H2O_Obara_Saika.inp Running RI_RPA_H2O_svd.inp Running RI_RPA_H2O_overlap_metric_svd.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-ri-rpa - RI_RPA_H2O.inp -17.145691221375827 OK ( 13.03 sec) - RI_RPA_H2O_overlap_metric.inp -17.145538849243540 OK ( 11.33 sec) - RI_RPA_CH3.inp -7.415612316029151 OK ( 16.06 sec) - RI_RPA_H2O_SYRK.inp -17.145691221375827 OK ( 12.56 sec) - RI_RPA_minimax_H_atom.inp -0.510122901484671 OK ( 4.89 sec) - RI_RPA_H2O_minimax.inp -17.145691263471022 OK ( 13.19 sec) - RI_RPA_H2O_PBE0.inp -17.122863632433326 OK ( 12.71 sec) - RI_RPA_H2O_PBE0_ADMM1.inp -17.125217824055309 OK ( 15.33 sec) - RI_RPA_H2O_Obara_Saika.inp -17.160204463747334 OK ( 5.04 sec) - RI_RPA_H2O_svd.inp -17.145632690184630 OK ( 10.96 sec) - RI_RPA_H2O_overlap_metric_svd.inp -17.145498315844495 OK ( 9.72 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-ri-rpa (2 of 45) done in 136.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-tddfpt (3 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-ri-rpa + RI_RPA_H2O.inp -17.145691221375827 OK ( 10.24 sec) + RI_RPA_H2O_overlap_metric.inp -17.145538849243540 OK ( 8.41 sec) + RI_RPA_CH3.inp -7.415612316029151 OK ( 11.22 sec) + RI_RPA_H2O_SYRK.inp -17.145691221375827 OK ( 9.74 sec) + RI_RPA_minimax_H_atom.inp -0.510122901484671 OK ( 3.22 sec) + RI_RPA_H2O_minimax.inp -17.145691263471022 OK ( 10.15 sec) + RI_RPA_H2O_PBE0.inp -17.122863632433329 OK ( 11.42 sec) + RI_RPA_H2O_PBE0_ADMM1.inp -17.125217824055298 OK ( 13.87 sec) + RI_RPA_H2O_Obara_Saika.inp -17.160204463747334 OK ( 4.34 sec) + RI_RPA_H2O_svd.inp -17.145632690184630 OK ( 10.04 sec) + RI_RPA_H2O_overlap_metric_svd.inp -17.145498315844495 OK ( 8.21 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-ri-rpa (2 of 45) done in 109.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-tddfpt (3 of 45) Running H2O_tddfpt-s-1.inp Running H2O_tddfpt-t-1.inp Running NO_tddfpt-s-1.inp @@ -49143,21 +49178,21 @@ Running NO_tddfpt-s-3.inp Running NO_tddfpt-t-3.inp Running H2O_tddfpt_NTO.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-tddfpt - H2O_tddfpt-s-1.inp 0.602948E+00 OK ( 1.19 sec) - H2O_tddfpt-t-1.inp 0.304878E+00 OK ( 0.94 sec) - NO_tddfpt-s-1.inp 0.348494E+00 OK ( 5.05 sec) - NO_tddfpt-t-1.inp 0.359779E+00 OK ( 4.70 sec) - H2O_tddfpt-s-2.inp 0.543390E+00 OK ( 1.11 sec) - H2O_tddfpt-t-2.inp 0.548605E+00 OK ( 1.32 sec) - NO_tddfpt-t-2.inp 0.358683E+00 OK ( 5.38 sec) - H2O_tddfpt-s-3.inp 0.543390E+00 OK ( 1.15 sec) - H2O_tddfpt-t-3.inp 0.579030E+00 OK ( 1.30 sec) - NO_tddfpt-s-3.inp 0.350929E+00 OK ( 2.71 sec) - NO_tddfpt-t-3.inp 0.358683E+00 OK ( 5.02 sec) - H2O_tddfpt_NTO.inp 0.551476E+00 OK ( 2.43 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-tddfpt (3 of 45) done in 43.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-libxc (4 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-tddfpt + H2O_tddfpt-s-1.inp 0.602948E+00 OK ( 0.90 sec) + H2O_tddfpt-t-1.inp 0.304878E+00 OK ( 0.70 sec) + NO_tddfpt-s-1.inp 0.348494E+00 OK ( 3.98 sec) + NO_tddfpt-t-1.inp 0.359779E+00 OK ( 4.48 sec) + H2O_tddfpt-s-2.inp 0.543390E+00 OK ( 1.00 sec) + H2O_tddfpt-t-2.inp 0.548605E+00 OK ( 0.96 sec) + NO_tddfpt-t-2.inp 0.358683E+00 OK ( 4.66 sec) + H2O_tddfpt-s-3.inp 0.543390E+00 OK ( 0.83 sec) + H2O_tddfpt-t-3.inp 0.579030E+00 OK ( 1.15 sec) + NO_tddfpt-s-3.inp 0.350929E+00 OK ( 2.73 sec) + NO_tddfpt-t-3.inp 0.358683E+00 OK ( 4.02 sec) + H2O_tddfpt_NTO.inp 0.551476E+00 OK ( 1.93 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-tddfpt (3 of 45) done in 36.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-libxc (4 of 45) Running H2O-hybrid-b3lyp_libxc_uks.inp Running H2O_pbe_libxc_tddfpt-s.inp Running H2O_lda_libxc_tddfpt-s.inp @@ -49169,20 +49204,20 @@ Running diamond_br89_libxc_uks.inp Running diamond_br89_libxc.inp Running H2O-tpss_lsd.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-libxc - H2O-hybrid-b3lyp_libxc_uks.inp -76.41035426581185 OK ( 3.92 sec) - H2O_pbe_libxc_tddfpt-s.inp -17.23116251470411 OK ( 3.46 sec) - H2O_lda_libxc_tddfpt-s.inp -17.13289833455466 OK ( 3.28 sec) - H2O_pbe_libxc_tddfpt-t_uks.inp -17.23116251474723 OK ( 7.40 sec) - H2O-hybrid-b3lyp_libxc.inp -76.41035426581183 OK ( 3.03 sec) - H2O-hybrid-tpssh_libxc.inp -76.40918264715266 OK ( 4.29 sec) - H2O_lda_libxc_tddfpt-t_uks.inp -17.13289833455855 OK ( 6.54 sec) - H2O-tpssx_libxc.inp -33.88300963208439 OK ( 2.33 sec) - diamond_br89_libxc_uks.inp -11.06581614908316 OK ( 28.07 sec) - diamond_br89_libxc.inp -11.06581614908315 OK ( 14.12 sec) - H2O-tpss_lsd.inp -34.34060245665610 OK ( 7.21 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-libxc (4 of 45) done in 93.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-hfx-periodic (5 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-libxc + H2O-hybrid-b3lyp_libxc_uks.inp -76.41035426581185 OK ( 3.52 sec) + H2O_pbe_libxc_tddfpt-s.inp -17.23116251470411 OK ( 2.93 sec) + H2O_lda_libxc_tddfpt-s.inp -17.13289833455465 OK ( 2.77 sec) + H2O_pbe_libxc_tddfpt-t_uks.inp -17.23116251474724 OK ( 6.17 sec) + H2O-hybrid-b3lyp_libxc.inp -76.41035426581183 OK ( 2.79 sec) + H2O-hybrid-tpssh_libxc.inp -76.40918264715266 OK ( 3.45 sec) + H2O_lda_libxc_tddfpt-t_uks.inp -17.13289833455856 OK ( 5.31 sec) + H2O-tpssx_libxc.inp -33.88300963208438 OK ( 2.04 sec) + diamond_br89_libxc_uks.inp -11.06581614908315 OK ( 27.53 sec) + diamond_br89_libxc.inp -11.06581614908316 OK ( 12.89 sec) + H2O-tpss_lsd.inp -34.34060245665611 OK ( 5.59 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-libxc (4 of 45) done in 83.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-hfx-periodic (5 of 45) Running H2O-trunc-2.inp Running H2O-trunc-auto.inp Running H2O-coul-0.inp @@ -49194,20 +49229,20 @@ Running h2o-respa.inp Running h2o-respa_restart.inp Running H2O-id-auto.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-hfx-periodic - H2O-trunc-2.inp -75.99943504501113 OK ( 2.66 sec) - H2O-trunc-auto.inp -75.99943504501113 OK ( 2.90 sec) - H2O-coul-0.inp -76.02314790926957 OK ( 2.04 sec) - H2O-trunc-auto-md.inp -0.752385976642E+02 OK ( 4.93 sec) - CH3-trunc-auto.inp -39.13005530688503 OK ( 4.03 sec) - CH3-trunc-1.inp -39.36116309682868 OK ( 4.70 sec) - CH3-trunc-auto-md.inp -0.387264301986E+02 OK ( 9.53 sec) - CH3-coul-0.inp -39.39910229689073 OK ( 4.41 sec) - h2o-respa.inp -76.02310918726100 OK ( 20.76 sec) - h2o-respa_restart.inp -76.02267217092368 OK ( 13.88 sec) - H2O-id-auto.inp -88.00800458675090 OK ( 2.12 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-hfx-periodic (5 of 45) done in 81.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-polar (6 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-hfx-periodic + H2O-trunc-2.inp -75.99943504501114 OK ( 2.28 sec) + H2O-trunc-auto.inp -75.99943504501113 OK ( 2.39 sec) + H2O-coul-0.inp -76.02314790926961 OK ( 1.83 sec) + H2O-trunc-auto-md.inp -0.752385976642E+02 OK ( 4.46 sec) + CH3-trunc-auto.inp -39.13005530688503 OK ( 3.48 sec) + CH3-trunc-1.inp -39.36116309682870 OK ( 3.68 sec) + CH3-trunc-auto-md.inp -0.387264301986E+02 OK ( 7.39 sec) + CH3-coul-0.inp -39.39910229689074 OK ( 3.31 sec) + h2o-respa.inp -76.02310918726106 OK ( 19.90 sec) + h2o-respa_restart.inp -76.02267217092370 OK ( 13.04 sec) + H2O-id-auto.inp -88.00800458675091 OK ( 1.83 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-hfx-periodic (5 of 45) done in 72.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-polar (6 of 45) Running h2o_LRraman.inp Running h2o_LRraman_loc.inp Running h2o_LRraman_noort.inp @@ -49215,21 +49250,21 @@ Running xTB_LRraman.inp Running xTB_LRraman_loc.inp Running h2o_LRraman_LRI.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-polar - h2o_LRraman.inp 0.006125121412 OK ( 0.54 sec) - h2o_LRraman_loc.inp 0.009153812508 OK ( 13.07 sec) - h2o_LRraman_noort.inp 0.023303680948 OK ( 2.76 sec) - H2O_md_polar.inp 0.635317998131 OK ( 29.91 sec) - xTB_LRraman.inp 0.804852847403 OK ( 0.20 sec) - xTB_LRraman_loc.inp 0.804852847403 OK ( 0.20 sec) - h2o_LRraman_LRI.inp 0.004262314774 OK ( 4.76 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-polar (6 of 45) done in 58.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-sccs-2 (7 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-polar + h2o_LRraman.inp 0.006125121412 OK ( 0.47 sec) + h2o_LRraman_loc.inp 0.009153812508 OK ( 10.60 sec) + h2o_LRraman_noort.inp 0.023303680948 OK ( 2.47 sec) + H2O_md_polar.inp 0.635317998131 OK ( 20.30 sec) + xTB_LRraman.inp 0.804852847403 OK ( 0.17 sec) + xTB_LRraman_loc.inp 0.804852847403 OK ( 0.18 sec) + h2o_LRraman_LRI.inp 0.004262314774 OK ( 4.41 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-polar (6 of 45) done in 44.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-sccs-2 (7 of 45) Running H2O_sccs_otdiis_cd5.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-sccs-2 - H2O_sccs_otdiis_cd5.inp -17.22654049703097 OK ( 13.85 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-sccs-2 (7 of 45) done in 16.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/MC/regtest (8 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-sccs-2 + H2O_sccs_otdiis_cd5.inp -17.22654049703096 OK ( 11.02 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-sccs-2 (7 of 45) done in 12.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/MC/regtest (8 of 45) Running MC_QS.inp Running MC_QS_restart.inp Running GEMC_NpT_box1.inp @@ -49240,26 +49275,26 @@ Running virial.inp Running hmc.inp Running MC_QS_cluster.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/MC/regtest - MC_QS.inp -51.34794469 OK ( 2.24 sec) - MC_QS_restart.inp -51.34909000 OK ( 2.81 sec) - GEMC_NpT_box1.inp 0.49826574 OK ( 2.21 sec) - GEMC_NVT_box1.inp 0.49803069 OK ( 2.31 sec) - GEMC_swap_box1.inp 0.55872200 OK ( 3.69 sec) - canonical.inp 0.55333815 OK ( 0.18 sec) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/MC/regtest + MC_QS.inp -51.34794469 OK ( 1.79 sec) + MC_QS_restart.inp -51.34909000 OK ( 2.28 sec) + GEMC_NpT_box1.inp 0.49826574 OK ( 2.01 sec) + GEMC_NVT_box1.inp 0.49803069 OK ( 1.85 sec) + GEMC_swap_box1.inp 0.55872200 OK ( 3.24 sec) + canonical.inp 0.55333815 OK ( 0.13 sec) canonical_bias.inp 0.38566238 OK ( 0.43 sec) - virial.inp -.723498E+03 OK ( 0.56 sec) - hmc.inp -2.49775342 OK ( 21.25 sec) - MC_QS_cluster.inp -123.50714373283125 OK ( 38.52 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/MC/regtest (8 of 45) done in 83.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-ps-implicit-2-3 (9 of 45) + virial.inp -.723498E+03 OK ( 0.49 sec) + hmc.inp -2.49775342 OK ( 15.86 sec) + MC_QS_cluster.inp -123.50714373283122 OK ( 27.14 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/MC/regtest (8 of 45) done in 63.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-ps-implicit-2-3 (9 of 45) Running H2O_mixed_periodic_cuboidal.inp Running H2O_mixed_periodic_cylindrical.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-ps-implicit-2-3 - H2O_mixed_periodic_cuboidal.inp -17.23631232134920 OK ( 33.05 sec) - H2O_mixed_periodic_cylindrical.inp -17.32193400042421 OK ( 19.87 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-ps-implicit-2-3 (9 of 45) done in 55.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/ATOM/regtest-2 (10 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-ps-implicit-2-3 + H2O_mixed_periodic_cuboidal.inp -17.23631232134920 OK ( 23.98 sec) + H2O_mixed_periodic_cylindrical.inp -17.32193400042430 OK ( 12.76 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-ps-implicit-2-3 (9 of 45) done in 39.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/ATOM/regtest-2 (10 of 45) Running H.inp Running He_1.inp Running He_2.inp @@ -49299,26 +49334,26 @@ Running C.inp Running C_ADMM.inp Running C_tpss.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/ATOM/regtest-2 - H.inp -0.499999999830 OK ( 0.28 sec) - He_1.inp -1.399307796698 OK ( 0.04 sec) - He_2.inp -1.336212351224 OK ( 0.04 sec) - He_3.inp -1.416270865184 OK ( 0.04 sec) - He_5.inp -1.408879880907 OK ( 0.04 sec) - F_1.inp -24.171954774816 OK ( 0.10 sec) - F_2.inp -24.171954774816 OK ( 0.09 sec) - F_3.inp -24.171954774816 OK ( 0.09 sec) - F_4.inp -23.517790822115 OK ( 0.08 sec) - F_5.inp -23.437623684262 OK ( 0.07 sec) - U.inp -25598.253318868839 OK ( 4.53 sec) - Ru.inp -15.9518066199 OK ( 2.69 sec) - Ru_basis.inp -15.951806619855 OK ( 0.07 sec) - Ru_conf.inp -15.9897774741 OK ( 7.12 sec) - atom_1.inp -0.462506882641 OK ( 0.07 sec) - atom_2.inp -0.356859139125 OK ( 0.08 sec) - atom_3.inp -0.462506882641 OK ( 0.12 sec) - atom_4.inp -0.146531730136 OK ( 0.08 sec) - atom_5.inp -0.462506882641 OK ( 0.07 sec) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/ATOM/regtest-2 + H.inp -0.499999999830 OK ( 0.23 sec) + He_1.inp -1.399307796698 OK ( 0.02 sec) + He_2.inp -1.336212351224 OK ( 0.02 sec) + He_3.inp -1.416270865184 OK ( 0.03 sec) + He_5.inp -1.408879880907 OK ( 0.03 sec) + F_1.inp -24.171954774816 OK ( 0.07 sec) + F_2.inp -24.171954774816 OK ( 0.07 sec) + F_3.inp -24.171954774816 OK ( 0.07 sec) + F_4.inp -23.517790822115 OK ( 0.05 sec) + F_5.inp -23.437623684262 OK ( 0.05 sec) + U.inp -25598.253318868839 OK ( 4.27 sec) + Ru.inp -15.9518066199 OK ( 2.36 sec) + Ru_basis.inp -15.951806619855 OK ( 0.05 sec) + Ru_conf.inp -15.9897774741 OK ( 4.08 sec) + atom_1.inp -0.462506882641 OK ( 0.06 sec) + atom_2.inp -0.356859139125 OK ( 0.05 sec) + atom_3.inp -0.462506882641 OK ( 0.05 sec) + atom_4.inp -0.146531730136 OK ( 0.06 sec) + atom_5.inp -0.462506882641 OK ( 0.05 sec) atom_c1.inp -0.460470116001 OK ( 0.03 sec) atom_c2.inp -0.348633649362 OK ( 0.03 sec) atom_c3.inp -0.460470116001 OK ( 0.03 sec) @@ -49326,21 +49361,21 @@ atom_c5.inp -0.460470116001 OK ( 0.03 sec) slater_0.inp -2.847630187388 OK ( 0.01 sec) slater_1.inp -526.292493965898 OK ( 0.01 sec) - slater_2.inp -24.243036046113 OK ( 0.26 sec) + slater_2.inp -24.243036046113 OK ( 0.21 sec) slater_3.inp -2.838751324071 OK ( 0.01 sec) - slater_4.inp 8.063992740899 OK ( 0.04 sec) + slater_4.inp 8.063992740899 OK ( 0.03 sec) slater_5.inp 109583.1142107928 OK ( 0.04 sec) - slater_6.inp 3762956.0625833506 OK ( 0.18 sec) - slater_7.inp -2.8616551247 OK ( 0.55 sec) - slater_8.inp -0.1875976021 OK ( 0.05 sec) - slater_9.inp -525.7615443522 OK ( 0.14 sec) + slater_6.inp 3762956.0625833506 OK ( 0.15 sec) + slater_7.inp -2.8616551247 OK ( 0.44 sec) + slater_8.inp -0.1875976021 OK ( 0.04 sec) + slater_9.inp -525.7615443522 OK ( 0.12 sec) slater_10.inp -2.841058209720 OK ( 0.01 sec) - Hg.inp -19601.624766751091 OK ( 2.91 sec) - C.inp -37.799871796427 OK ( 0.31 sec) - C_ADMM.inp -37.758721798836 OK ( 0.26 sec) - C_tpss.inp -37.801438870459 OK ( 0.59 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/ATOM/regtest-2 (10 of 45) done in 60.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/LIBTEST (11 of 45) + Hg.inp -19601.624766751091 OK ( 2.51 sec) + C.inp -37.799871796427 OK ( 0.25 sec) + C_ADMM.inp -37.758721798836 OK ( 0.17 sec) + C_tpss.inp -37.801438870459 OK ( 0.34 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/ATOM/regtest-2 (10 of 45) done in 42.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/LIBTEST (11 of 45) Running test_01.inp Running test_02.inp Running test_pw.inp @@ -49377,56 +49412,56 @@ Running grid_validate_ortho.inp Running grid_ref_backend_nonortho.inp Running grid_validate_nonortho.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/LIBTEST - test_01.inp - OK ( 8.69 sec) - test_02.inp - OK ( 1.54 sec) - test_pw.inp - OK ( 0.27 sec) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/LIBTEST + test_01.inp - OK ( 4.48 sec) + test_02.inp - OK ( 1.13 sec) + test_pw.inp - OK ( 0.17 sec) test_pw_02.inp - OK ( 0.01 sec) test_pw_03.inp - OK ( 0.01 sec) - test_pw_04.inp - OK ( 17.28 sec) - test_pw_05.inp - OK ( 0.02 sec) - test_cp_fm_gemm_01.inp - OK ( 1.46 sec) - test_cp_fm_gemm_02.inp - OK ( 1.47 sec) - eig.inp - OK ( 0.02 sec) - dbcsr_mm_blas.inp - OK ( 0.07 sec) - dbcsr_multistack.inp - OK ( 0.27 sec) - dbcsr_types.inp - OK ( 0.26 sec) - dbcsr_blocks_01.inp 20978908949.261906 OK ( 1.23 sec) - dbcsr_blocks_02.inp 21229174127.238159 OK ( 0.89 sec) - dbcsr_blocks_03.inp 21561533688.640675 OK ( 1.08 sec) - dbcsr_blocks_04.inp 21304439095.777740 OK ( 0.80 sec) - dbcsr_blocks_05.inp 21455488291.450737 OK ( 1.01 sec) - dbcsr_types_01.inp 272584373.29241335 OK ( 0.24 sec) + test_pw_04.inp - OK ( 11.60 sec) + test_pw_05.inp - OK ( 0.01 sec) + test_cp_fm_gemm_01.inp - OK ( 1.08 sec) + test_cp_fm_gemm_02.inp - OK ( 1.03 sec) + eig.inp - OK ( 0.01 sec) + dbcsr_mm_blas.inp - OK ( 0.05 sec) + dbcsr_multistack.inp - OK ( 0.20 sec) + dbcsr_types.inp - OK ( 0.21 sec) + dbcsr_blocks_01.inp 20978908949.261906 OK ( 0.90 sec) + dbcsr_blocks_02.inp 21229174127.238159 OK ( 1.13 sec) + dbcsr_blocks_03.inp 21561533688.640675 OK ( 0.85 sec) + dbcsr_blocks_04.inp 21304439095.777740 OK ( 0.95 sec) + dbcsr_blocks_05.inp 21455488291.450737 OK ( 0.84 sec) + dbcsr_types_01.inp 272584373.29241335 OK ( 0.25 sec) dbcsr_types_02.inp 272584373.29241335 OK ( 0.26 sec) - dbcsr_types_03.inp 272584373.29241335 OK ( 0.27 sec) - dbcsr_types_04.inp 272584373.29241335 OK ( 0.26 sec) - dbcsr_types_05.inp 272584373.29241335 OK ( 0.24 sec) - dbcsr_io_1.inp - OK ( 0.11 sec) - dbcsr_order_N.inp 1910924.8949438259 OK ( 4.46 sec) - test_eri_mme_accuracy.inp - OK ( 1.51 sec) - test_eri_mme_accuracy_longrange.inp - OK ( 1.89 sec) - test_eri_mme_accuracy_yukawa.inp - OK ( 1.49 sec) - test_eri_mme_performance.inp - OK ( 2.27 sec) - test_minimax.inp - OK ( 1.51 sec) - test_shg_integrals_01.inp - OK ( 2.62 sec) - test_shg_integrals_02.inp - OK ( 1.50 sec) - grid_ref_backend_ortho.inp -21.04944231395037 OK ( 1.15 sec) - grid_validate_ortho.inp -21.04944231395037 OK ( 1.57 sec) - grid_ref_backend_nonortho.inp -18.04976254477840 OK ( 0.52 sec) - grid_validate_nonortho.inp -18.04976254477837 OK ( 0.86 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/LIBTEST (11 of 45) done in 96.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-hfx-stress (12 of 45) + dbcsr_types_03.inp 272584373.29241335 OK ( 0.22 sec) + dbcsr_types_04.inp 272584373.29241335 OK ( 0.21 sec) + dbcsr_types_05.inp 272584373.29241335 OK ( 0.21 sec) + dbcsr_io_1.inp - OK ( 0.09 sec) + dbcsr_order_N.inp 1910924.8949438259 OK ( 3.48 sec) + test_eri_mme_accuracy.inp - OK ( 1.23 sec) + test_eri_mme_accuracy_longrange.inp - OK ( 1.73 sec) + test_eri_mme_accuracy_yukawa.inp - OK ( 1.23 sec) + test_eri_mme_performance.inp - OK ( 1.95 sec) + test_minimax.inp - OK ( 1.25 sec) + test_shg_integrals_01.inp - OK ( 2.19 sec) + test_shg_integrals_02.inp - OK ( 1.12 sec) + grid_ref_backend_ortho.inp -21.04944231395036 OK ( 0.61 sec) + grid_validate_ortho.inp -21.04944231395037 OK ( 0.73 sec) + grid_ref_backend_nonortho.inp -18.04976254477837 OK ( 0.26 sec) + grid_validate_nonortho.inp -18.04976254477837 OK ( 0.40 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/LIBTEST (11 of 45) done in 65.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-hfx-stress (12 of 45) Running ch3-admm.inp Running ch3.inp Running ch4-admm.inp Running h2o.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-hfx-stress - ch3-admm.inp -7.17220679251E+00 OK ( 20.67 sec) - ch3.inp 2.83902802123E+01 OK ( 9.08 sec) - ch4-admm.inp -7.10694854891E+00 OK ( 15.49 sec) - h2o.inp 1.26297506368E+01 OK ( 6.54 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-hfx-stress (12 of 45) done in 59.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/DFTB/regtest-nonscc (13 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-hfx-stress + ch3-admm.inp -7.17220679364E+00 OK ( 11.90 sec) + ch3.inp 2.83902802123E+01 OK ( 5.45 sec) + ch4-admm.inp -7.10694854720E+00 OK ( 9.97 sec) + h2o.inp 1.26297506368E+01 OK ( 3.60 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-hfx-stress (12 of 45) done in 35.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/DFTB/regtest-nonscc (13 of 45) Running ch2o-1.inp Running ch2o-2.inp Running ch2o-3.inp @@ -49450,32 +49485,32 @@ Running co2_3.inp Running si_kp1.inp Running si_kp2.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/DFTB/regtest-nonscc - ch2o-1.inp -5.82072731467941 OK ( 0.08 sec) - ch2o-2.inp -5.82159061359820 OK ( 0.23 sec) - ch2o-3.inp -5.81373413468792 OK ( 0.23 sec) - ch2o-r.inp -5.81373413468792 OK ( 0.24 sec) - h2-1.inp -0.70875565358819 OK ( 0.06 sec) - h2-2.inp -0.70875565358819 OK ( 0.29 sec) - h2-3.inp -0.70875565358819 OK ( 0.06 sec) - h2-4.inp -0.71042952969308 OK ( 0.20 sec) - h2o-32_1.inp -131.08636939008764 OK ( 1.47 sec) - h2o-32_2.inp -131.07999691054354 OK ( 1.46 sec) - h2o-32_3.inp -131.07520911566405 OK ( 0.94 sec) - h2o-32_4.inp -131.07520911521181 OK ( 6.99 sec) - MoS.inp -2.99616182900092 OK ( 0.53 sec) - n2.inp -4.86560729572791 OK ( 1.96 sec) - s2.inp -4.83731808711856 OK ( 0.64 sec) - ch2o_atprop.inp -5.81281420275335 OK ( 0.20 sec) - MoS_atprop.inp -2.99616182900092 OK ( 0.84 sec) - h2o-32_atprop.inp -131.08636939008764 OK ( 1.52 sec) - co2_1.inp -8.55586246566685 OK ( 0.16 sec) - co2_2.inp -8.55586246566686 OK ( 0.18 sec) - co2_3.inp -8.55586246566686 OK ( 0.13 sec) - si_kp1.inp -10.06358203475393 OK ( 2.38 sec) - si_kp2.inp - OK ( 16.92 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/DFTB/regtest-nonscc (13 of 45) done in 76.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-hirshfeld (14 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/DFTB/regtest-nonscc + ch2o-1.inp -5.82072731467941 OK ( 0.06 sec) + ch2o-2.inp -5.82159061359820 OK ( 0.10 sec) + ch2o-3.inp -5.81373413468792 OK ( 0.10 sec) + ch2o-r.inp -5.81373413468792 OK ( 0.11 sec) + h2-1.inp -0.70875565358819 OK ( 0.03 sec) + h2-2.inp -0.70875565358819 OK ( 0.03 sec) + h2-3.inp -0.70875565358819 OK ( 0.03 sec) + h2-4.inp -0.71042952969308 OK ( 0.10 sec) + h2o-32_1.inp -131.08636939008764 OK ( 0.93 sec) + h2o-32_2.inp -131.07999691054354 OK ( 0.91 sec) + h2o-32_3.inp -131.07520911566405 OK ( 0.61 sec) + h2o-32_4.inp -131.07520911521181 OK ( 4.93 sec) + MoS.inp -2.99616182900092 OK ( 0.29 sec) + n2.inp -4.86560729572791 OK ( 0.58 sec) + s2.inp -4.83731808711856 OK ( 0.12 sec) + ch2o_atprop.inp -5.81281420275335 OK ( 0.06 sec) + MoS_atprop.inp -2.99616182900092 OK ( 0.29 sec) + h2o-32_atprop.inp -131.08636939008764 OK ( 0.92 sec) + co2_1.inp -8.55586246566685 OK ( 0.05 sec) + co2_2.inp -8.55586246566686 OK ( 0.05 sec) + co2_3.inp -8.55586246566686 OK ( 0.04 sec) + si_kp1.inp -10.06358203475393 OK ( 1.06 sec) + si_kp2.inp - OK ( 8.72 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/DFTB/regtest-nonscc (13 of 45) done in 36.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-hirshfeld (14 of 45) Running htest_1.inp Running htest_2.inp Running htest_3.inp @@ -49494,27 +49529,27 @@ Running hlsd_7.inp Running hlsd_8.inp Running hlsd_9.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-hirshfeld - htest_1.inp -17.14603641519600 OK ( 1.34 sec) - htest_2.inp -17.14603641519600 OK ( 0.98 sec) - htest_3.inp -17.14603641519600 OK ( 0.80 sec) - htest_4.inp -17.14603641519600 OK ( 0.59 sec) - htest_5.inp -17.14603641519600 OK ( 0.58 sec) - htest_6.inp -17.14603641519600 OK ( 0.95 sec) - htest_7.inp -17.13771713041175 OK ( 0.68 sec) - htest_8.inp -17.13771713041175 OK ( 0.99 sec) - htest_9.inp -17.13771713041175 OK ( 1.22 sec) - hlsd_1.inp -16.81101156813313 OK ( 1.25 sec) - hlsd_2.inp -16.81101156813313 OK ( 1.39 sec) - hlsd_3.inp -16.81101156813313 OK ( 1.24 sec) - hlsd_4.inp -16.81101156813313 OK ( 1.24 sec) - hlsd_5.inp -16.81101156813313 OK ( 1.36 sec) - hlsd_6.inp -16.80070757658129 OK ( 1.91 sec) - hlsd_7.inp -16.80070757658130 OK ( 1.00 sec) - hlsd_8.inp -16.80070757658130 OK ( 1.30 sec) - hlsd_9.inp -16.80070757658130 OK ( 1.17 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-hirshfeld (14 of 45) done in 46.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-gpw-2-1 (15 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-hirshfeld + htest_1.inp -17.14603641519600 OK ( 0.36 sec) + htest_2.inp -17.14603641519600 OK ( 0.36 sec) + htest_3.inp -17.14603641519600 OK ( 0.40 sec) + htest_4.inp -17.14603641519600 OK ( 0.35 sec) + htest_5.inp -17.14603641519600 OK ( 0.34 sec) + htest_6.inp -17.14603641519600 OK ( 0.52 sec) + htest_7.inp -17.13771713041175 OK ( 0.42 sec) + htest_8.inp -17.13771713041175 OK ( 0.42 sec) + htest_9.inp -17.13771713041175 OK ( 0.58 sec) + hlsd_1.inp -16.81101156813313 OK ( 0.63 sec) + hlsd_2.inp -16.81101156813313 OK ( 0.91 sec) + hlsd_3.inp -16.81101156813313 OK ( 0.64 sec) + hlsd_4.inp -16.81101156813313 OK ( 0.64 sec) + hlsd_5.inp -16.81101156813313 OK ( 0.83 sec) + hlsd_6.inp -16.80070757658130 OK ( 0.77 sec) + hlsd_7.inp -16.80070757658130 OK ( 0.78 sec) + hlsd_8.inp -16.80070757658130 OK ( 1.05 sec) + hlsd_9.inp -16.80070757658130 OK ( 1.04 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-hirshfeld (14 of 45) done in 23.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-gpw-2-1 (15 of 45) Running H2-vib.inp Running H2-vib_tc.inp Running H2O-2.inp @@ -49523,17 +49558,17 @@ Running ZrO.inp Running Ar-12.inp Running Ar-13.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-gpw-2-1 - H2-vib.inp 3855.524137 OK ( 5.23 sec) - H2-vib_tc.inp -5.75148845 OK ( 7.25 sec) - H2O-2.inp -17.14619644944920 OK ( 2.00 sec) - H2O-3.inp -17.14553123442888 OK ( 1.44 sec) - H2O-4.inp -17.14677584577017 OK ( 2.66 sec) - ZrO.inp -62.20520122490161 OK ( 0.89 sec) - Ar-12.inp -21.04251999575884 OK ( 2.08 sec) - Ar-13.inp -21.12624107439688 OK ( 1.88 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-gpw-2-1 (15 of 45) done in 36.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/DFTB/regtest (16 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-gpw-2-1 + H2-vib.inp 3855.524137 OK ( 4.49 sec) + H2-vib_tc.inp -5.75148845 OK ( 4.52 sec) + H2O-2.inp -17.14619644944919 OK ( 0.81 sec) + H2O-3.inp -17.14553123442888 OK ( 0.92 sec) + H2O-4.inp -17.14677584577016 OK ( 0.85 sec) + ZrO.inp -62.20520122490161 OK ( 0.41 sec) + Ar-12.inp -21.04251999575885 OK ( 0.77 sec) + Ar-13.inp -21.12624107439688 OK ( 0.72 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-gpw-2-1 (15 of 45) done in 20.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/DFTB/regtest (16 of 45) Running wdim_scc.inp Running wdim_nonscc.inp Running wdimmc_scc.inp @@ -49549,35 +49584,35 @@ Running fdeb_5.inp Running fdeb_6.inp Running fdeb_7.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/DFTB/regtest - wdim_scc.inp -4.07355023693330 OK ( 0.16 sec) - wdim_nonscc.inp -4.10498450145550 OK ( 0.30 sec) - wdimmc_scc.inp -4.07060757309577 OK ( 0.15 sec) - wdimmc_nonscc.inp -4.10169797261566 OK ( 0.33 sec) - epc_1.inp -4.07357205844602 OK ( 0.42 sec) - epc_2.inp -4.07355023693330 OK ( 0.53 sec) - epc_3.inp -4.10500910796087 OK ( 0.21 sec) - epc_4.inp -4.07358020377115 OK ( 0.23 sec) - fdeb_1.inp - OK ( 2.07 sec) - fdeb_2.inp - OK ( 2.06 sec) - fdeb_3.inp - OK ( 2.44 sec) - fdeb_4.inp - OK ( 1.86 sec) - fdeb_5.inp - OK ( 1.52 sec) - fdeb_6.inp - OK ( 2.24 sec) - fdeb_7.inp - OK ( 2.84 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/DFTB/regtest (16 of 45) done in 42.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/QS/regtest-gapw (17 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/DFTB/regtest + wdim_scc.inp -4.07355023693330 OK ( 0.08 sec) + wdim_nonscc.inp -4.10498450145550 OK ( 0.09 sec) + wdimmc_scc.inp -4.07060757309577 OK ( 0.09 sec) + wdimmc_nonscc.inp -4.10169797261566 OK ( 0.09 sec) + epc_1.inp -4.07357205844602 OK ( 0.10 sec) + epc_2.inp -4.07355023693330 OK ( 0.08 sec) + epc_3.inp -4.10500910796087 OK ( 0.10 sec) + epc_4.inp -4.07358020377115 OK ( 0.14 sec) + fdeb_1.inp - OK ( 0.86 sec) + fdeb_2.inp - OK ( 0.92 sec) + fdeb_3.inp - OK ( 0.77 sec) + fdeb_4.inp - OK ( 1.11 sec) + fdeb_5.inp - OK ( 0.74 sec) + fdeb_6.inp - OK ( 1.08 sec) + fdeb_7.inp - OK ( 1.55 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/DFTB/regtest (16 of 45) done in 18.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/QS/regtest-gapw (17 of 45) Running C11H24-qmmmgapwall-gauss-0.inp Running C11H24-qmmmgapw-gauss-0.inp Running H2O-qmmm-gapw-fdbg.inp Running H2O-qmmm-hfx.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/QS/regtest-gapw - C11H24-qmmmgapwall-gauss-0.inp -156.88271046730770 OK ( 4.36 sec) - C11H24-qmmmgapw-gauss-0.inp -28.0421973526 OK ( 4.20 sec) - H2O-qmmm-gapw-fdbg.inp -16.93909155475011 OK ( 10.22 sec) - H2O-qmmm-hfx.inp -0.176043379384E+02 OK ( 7.11 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/QS/regtest-gapw (17 of 45) done in 32.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/QS/regtest-4 (18 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/QS/regtest-gapw + C11H24-qmmmgapwall-gauss-0.inp -156.88271046730767 OK ( 2.33 sec) + C11H24-qmmmgapw-gauss-0.inp -28.0421973526 OK ( 2.65 sec) + H2O-qmmm-gapw-fdbg.inp -16.93909155475014 OK ( 6.69 sec) + H2O-qmmm-hfx.inp -0.176043379384E+02 OK ( 5.53 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/QS/regtest-gapw (17 of 45) done in 21.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/QS/regtest-4 (18 of 45) Running crys_per_qmmm.inp Running crys_per_qmmm_anal.inp Running crys_per_qmmm_spln.inp @@ -49585,16 +49620,16 @@ Running acn-qmmm-re.inp Running acn-conn-1.inp Running wat_nacl.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/QS/regtest-4 - crys_per_qmmm.inp -0.08375440741138 OK ( 3.38 sec) - crys_per_qmmm_anal.inp -0.03306937253920 OK ( 3.01 sec) - crys_per_qmmm_spln.inp -0.03306936689225 OK ( 3.74 sec) - crys_per_qmmm_none.inp -0.08375440741158 OK ( 2.88 sec) - acn-qmmm-re.inp -14.78512402428232 OK ( 1.71 sec) - acn-conn-1.inp -291.98859227602725 OK ( 9.19 sec) - wat_nacl.inp -16.691503876245207 OK ( 8.74 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/QS/regtest-4 (18 of 45) done in 45.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/SE/regtest_2 (19 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/QS/regtest-4 + crys_per_qmmm.inp -0.08375440741138 OK ( 2.23 sec) + crys_per_qmmm_anal.inp -0.03306937253920 OK ( 2.15 sec) + crys_per_qmmm_spln.inp -0.03306936689225 OK ( 2.13 sec) + crys_per_qmmm_none.inp -0.08375440741158 OK ( 1.37 sec) + acn-qmmm-re.inp -14.78512402427866 OK ( 0.69 sec) + acn-conn-1.inp -291.98859227597751 OK ( 5.16 sec) + wat_nacl.inp -16.691503876245207 OK ( 2.48 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/QS/regtest-4 (18 of 45) done in 22.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/SE/regtest_2 (19 of 45) Running nh3_g4x6_excl_mm.inp Running nh3_g4x6_excl_qm.inp Running water_colv_excl_mm.inp @@ -49604,38 +49639,38 @@ Running water_g3x3_excl_mm.inp Running water_g3x3_excl_qm.inp Running Si_tersoff_qmmm.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/SE/regtest_2 - nh3_g4x6_excl_mm.inp -0.913069017786E+01 OK ( 2.60 sec) - nh3_g4x6_excl_qm.inp -0.913127863162E+01 OK ( 2.23 sec) - water_colv_excl_mm.inp -0.128071776255E+02 OK ( 3.12 sec) - water_colv_excl_qm.inp -0.128078086386E+02 OK ( 1.98 sec) - water_fixd_excl_mm.inp -0.128094856912E+02 OK ( 1.12 sec) - water_fixd_excl_qm.inp -0.128087667071E+02 OK ( 1.22 sec) - water_g3x3_excl_mm.inp -0.128057061878E+02 OK ( 1.62 sec) - water_g3x3_excl_qm.inp -0.128090813557E+02 OK ( 1.53 sec) - Si_tersoff_qmmm.inp -3418.06809308977336 OK ( 13.87 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/SE/regtest_2 (19 of 45) done in 46.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-mp2-1 (20 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/SE/regtest_2 + nh3_g4x6_excl_mm.inp -0.913069017786E+01 OK ( 0.62 sec) + nh3_g4x6_excl_qm.inp -0.913127863162E+01 OK ( 0.70 sec) + water_colv_excl_mm.inp -0.128071776255E+02 OK ( 0.68 sec) + water_colv_excl_qm.inp -0.128078086386E+02 OK ( 0.63 sec) + water_fixd_excl_mm.inp -0.128094856912E+02 OK ( 0.44 sec) + water_fixd_excl_qm.inp -0.128087667071E+02 OK ( 0.65 sec) + water_g3x3_excl_mm.inp -0.128057061878E+02 OK ( 0.51 sec) + water_g3x3_excl_qm.inp -0.128090813557E+02 OK ( 0.62 sec) + Si_tersoff_qmmm.inp -3418.06809308977336 OK ( 6.34 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/SE/regtest_2 (19 of 45) done in 18.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-mp2-1 (20 of 45) Running H2O-01.inp Running Li.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-mp2-1 - H2O-01.inp -76.263035235006953 OK ( 12.25 sec) - Li.inp -7.442887463667534 OK ( 8.68 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-mp2-1 (20 of 45) done in 24.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-gapw-2 (21 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-mp2-1 + H2O-01.inp -76.263035235007052 OK ( 5.72 sec) + Li.inp -7.442887463667534 OK ( 8.42 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-mp2-1 (20 of 45) done in 16.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-gapw-2 (21 of 45) Running Li-ROKS.inp Running NO2-ROKS.inp Running C-levelshift.inp Running H2-pbe-restart-run.inp Running H2-pbe-restart-rerun.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-gapw-2 - Li-ROKS.inp -7.33891040994158 OK ( 1.41 sec) - NO2-ROKS.inp -203.77833570926830 OK ( 3.36 sec) - C-levelshift.inp -37.44694658478038 OK ( 2.76 sec) - H2-pbe-restart-run.inp -0.60698327541572 OK ( 7.22 sec) - H2-pbe-restart-rerun.inp -0.60698327541578 OK ( 2.90 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-gapw-2 (21 of 45) done in 27.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/QS/regtest-2-erf (22 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-gapw-2 + Li-ROKS.inp -7.33891040994158 OK ( 1.22 sec) + NO2-ROKS.inp -203.77833570926819 OK ( 2.60 sec) + C-levelshift.inp -37.44694658478038 OK ( 1.30 sec) + H2-pbe-restart-run.inp -0.60698327541572 OK ( 4.04 sec) + H2-pbe-restart-rerun.inp -0.60698327541578 OK ( 1.18 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-gapw-2 (21 of 45) done in 15.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/QS/regtest-2-erf (22 of 45) Running H2O-qmmm-gauss-14-geep-2.inp Running H2O-qmmm-gauss-14-geep-3.inp Running H2O-qmmm-gauss-14-geep-4.inp @@ -49653,26 +49688,26 @@ Running H2O-qmmm-gauss-14-geep-16.inp Running H2O-qmmm-gauss-14-geep-17.inp Running H2O-qmmm-gauss-14-geep-18.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/QS/regtest-2-erf - H2O-qmmm-gauss-14-geep-2.inp -12.90417644796132 OK ( 0.61 sec) - H2O-qmmm-gauss-14-geep-3.inp -12.90712061195513 OK ( 0.57 sec) - H2O-qmmm-gauss-14-geep-4.inp -12.90733560861444 OK ( 0.58 sec) - H2O-qmmm-gauss-14-geep-5.inp -12.92642686633616 OK ( 0.64 sec) - H2O-qmmm-gauss-14-geep-6.inp -12.92230602229929 OK ( 0.99 sec) - H2O-qmmm-gauss-14-geep-7.inp -12.91849696653134 OK ( 0.83 sec) - H2O-qmmm-gauss-14-geep-8.inp -12.91621682584140 OK ( 0.65 sec) - H2O-qmmm-gauss-14-geep-9.inp -12.91437166178052 OK ( 0.62 sec) - H2O-qmmm-gauss-14-geep-10.inp -12.91328069125532 OK ( 0.85 sec) - H2O-qmmm-gauss-14-geep-11.inp -12.91297474164520 OK ( 0.92 sec) - H2O-qmmm-gauss-14-geep-12.inp -12.91332340554816 OK ( 0.49 sec) - H2O-qmmm-gauss-14-geep-13.inp -12.91325023093018 OK ( 0.71 sec) - H2O-qmmm-gauss-14-geep-14.inp -12.91299456138502 OK ( 0.88 sec) - H2O-qmmm-gauss-14-geep-15.inp -12.91325018773295 OK ( 2.48 sec) - H2O-qmmm-gauss-14-geep-16.inp -12.91325925146000 OK ( 2.42 sec) - H2O-qmmm-gauss-14-geep-17.inp -12.91336718381622 OK ( 2.48 sec) - H2O-qmmm-gauss-14-geep-18.inp -12.91336753630966 OK ( 3.40 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/QS/regtest-2-erf (22 of 45) done in 51.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-md-lgvregion (23 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/QS/regtest-2-erf + H2O-qmmm-gauss-14-geep-2.inp -12.90417644796132 OK ( 0.27 sec) + H2O-qmmm-gauss-14-geep-3.inp -12.90712061195513 OK ( 0.27 sec) + H2O-qmmm-gauss-14-geep-4.inp -12.90733560861444 OK ( 0.27 sec) + H2O-qmmm-gauss-14-geep-5.inp -12.92642686633616 OK ( 0.28 sec) + H2O-qmmm-gauss-14-geep-6.inp -12.92230602229929 OK ( 0.28 sec) + H2O-qmmm-gauss-14-geep-7.inp -12.91849696653134 OK ( 0.30 sec) + H2O-qmmm-gauss-14-geep-8.inp -12.91621682584141 OK ( 0.31 sec) + H2O-qmmm-gauss-14-geep-9.inp -12.91437166178052 OK ( 0.31 sec) + H2O-qmmm-gauss-14-geep-10.inp -12.91328069125532 OK ( 0.31 sec) + H2O-qmmm-gauss-14-geep-11.inp -12.91297474164520 OK ( 0.31 sec) + H2O-qmmm-gauss-14-geep-12.inp -12.91332340554816 OK ( 0.33 sec) + H2O-qmmm-gauss-14-geep-13.inp -12.91325023093018 OK ( 0.38 sec) + H2O-qmmm-gauss-14-geep-14.inp -12.91299456138501 OK ( 0.52 sec) + H2O-qmmm-gauss-14-geep-15.inp -12.91325018773295 OK ( 1.86 sec) + H2O-qmmm-gauss-14-geep-16.inp -12.91325925146000 OK ( 1.81 sec) + H2O-qmmm-gauss-14-geep-17.inp -12.91336718381622 OK ( 1.98 sec) + H2O-qmmm-gauss-14-geep-18.inp -12.91336753630966 OK ( 2.58 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/QS/regtest-2-erf (22 of 45) done in 24.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-md-lgvregion (23 of 45) Running langevin_regions-1.inp Running langevin_regions-2.inp Running langevin_regions-3.inp @@ -49680,41 +49715,41 @@ Running langevin_regions-5.inp Running langevin_regions-6.inp Running langevin_regions-7.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-md-lgvregion - langevin_regions-1.inp -34.28350497030243 OK ( 2.96 sec) - langevin_regions-2.inp -34.29678091855003 OK ( 2.57 sec) - langevin_regions-3.inp -34.28350497030240 OK ( 2.31 sec) - langevin_regions-4.inp -34.28727330165423 OK ( 2.58 sec) - langevin_regions-5.inp -34.36743843099259 OK ( 2.28 sec) - langevin_regions-6.inp -34.36335813030902 OK ( 2.16 sec) - langevin_regions-7.inp -34.37404120268194 OK ( 2.12 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-md-lgvregion (23 of 45) done in 26.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-almo-eda (24 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-md-lgvregion + langevin_regions-1.inp -34.28350497030247 OK ( 1.29 sec) + langevin_regions-2.inp -34.29678091855070 OK ( 1.28 sec) + langevin_regions-3.inp -34.28350497030369 OK ( 1.38 sec) + langevin_regions-4.inp -34.28727330165425 OK ( 1.33 sec) + langevin_regions-5.inp -34.36743843099344 OK ( 1.79 sec) + langevin_regions-6.inp -34.36335813030962 OK ( 1.79 sec) + langevin_regions-7.inp -34.37404120268194 OK ( 1.79 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-md-lgvregion (23 of 45) done in 16.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-almo-eda (24 of 45) Running almo-eda-x.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-almo-eda - almo-eda-x.inp -85.963743073053308 OK ( 17.52 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-almo-eda (24 of 45) done in 20.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-epr-2 (25 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-almo-eda + almo-eda-x.inp -85.963743073053337 OK ( 12.85 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-almo-eda (24 of 45) done in 15.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-epr-2 (25 of 45) Running NO2-EPR-1.inp Running NO2-EPR-2.inp Running NO2-EPR-3.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-epr-2 - NO2-EPR-1.inp -0.344563E-02 OK ( 8.47 sec) - NO2-EPR-2.inp -0.252817E-02 OK ( 2.81 sec) - NO2-EPR-3.inp -0.358602E-02 OK ( 3.61 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-epr-2 (25 of 45) done in 18.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-hybrid-1 (26 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-epr-2 + NO2-EPR-1.inp -0.344563E-02 OK ( 6.21 sec) + NO2-EPR-2.inp -0.252817E-02 OK ( 2.39 sec) + NO2-EPR-3.inp -0.358602E-02 OK ( 3.24 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-epr-2 (25 of 45) done in 14.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-hybrid-1 (26 of 45) Running H2O-hybrid-bhandh.inp Running H2O-hybrid-bhandhlyp.inp Running H2O-hybrid-pbe0.inp Running H2O-hybrid-b3lyp.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-hybrid-1 - H2O-hybrid-bhandh.inp -75.90482120088643 OK ( 2.49 sec) - H2O-hybrid-bhandhlyp.inp -76.33558053104217 OK ( 4.50 sec) - H2O-hybrid-pbe0.inp -76.31995335312716 OK ( 8.92 sec) - H2O-hybrid-b3lyp.inp -76.37338940401892 OK ( 15.08 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-hybrid-1 (26 of 45) done in 38.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/FARMING/regtest-1 (27 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-hybrid-1 + H2O-hybrid-bhandh.inp -75.90482120088643 OK ( 2.21 sec) + H2O-hybrid-bhandhlyp.inp -76.33558053104217 OK ( 2.19 sec) + H2O-hybrid-pbe0.inp -76.31995335312718 OK ( 2.31 sec) + H2O-hybrid-b3lyp.inp -76.37338940401892 OK ( 2.28 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-hybrid-1 (26 of 45) done in 12.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/FARMING/regtest-1 (27 of 45) Running farming-1.inp Running farming-2.inp Running farming-3.inp @@ -49724,18 +49759,18 @@ Running farming-7.inp Running farming-8.inp Running farming-9.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/FARMING/regtest-1 - farming-1.inp - OK ( 5.23 sec) - farming-2.inp - OK ( 3.13 sec) - farming-3.inp - OK ( 3.01 sec) - farming-4.inp - OK ( 3.38 sec) - farming-5.inp - OK ( 2.93 sec) - farming-6.inp - OK ( 2.28 sec) - farming-7.inp - OK ( 2.85 sec) - farming-8.inp - OK ( 1.45 sec) - farming-9.inp - OK ( 0.34 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/FARMING/regtest-1 (27 of 45) done in 42.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-ot-refine-3 (28 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/FARMING/regtest-1 + farming-1.inp - OK ( 0.71 sec) + farming-2.inp - OK ( 0.70 sec) + farming-3.inp - OK ( 0.70 sec) + farming-4.inp - OK ( 0.74 sec) + farming-5.inp - OK ( 0.81 sec) + farming-6.inp - OK ( 0.62 sec) + farming-7.inp - OK ( 0.68 sec) + farming-8.inp - OK ( 0.70 sec) + farming-9.inp - OK ( 0.14 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/FARMING/regtest-1 (27 of 45) done in 12.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-ot-refine-3 (28 of 45) Running h2o_ot_lwdn_on_the_fly_l1.inp Running h2o_ot_poly_on_the_fly_l1.inp Running o2_ot_lwdn_on_the_fly_l1.inp @@ -49748,21 +49783,21 @@ Running h2o_ot_precond_2.inp Running h2o_ot_precond_3.inp Running h2o_ot_precond_4.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-ot-refine-3 - h2o_ot_lwdn_on_the_fly_l1.inp -17.13045715683766 OK ( 0.68 sec) - h2o_ot_poly_on_the_fly_l1.inp -17.13045715683766 OK ( 0.67 sec) - o2_ot_lwdn_on_the_fly_l1.inp -31.70815200232900 OK ( 1.14 sec) - o2_ot_poly_on_the_fly_l1.inp -31.70815200232901 OK ( 1.11 sec) - h2o_ot_refine_3.inp -17.08884672065215 OK ( 0.95 sec) - h2o_ot_refine_4.inp -17.11857283464191 OK ( 0.56 sec) - o2_ot_refine_3.inp -31.60858514413055 OK ( 1.23 sec) - o2_ot_refine_4.inp -31.58768162895354 OK ( 0.89 sec) - h2o_ot_precond_1.inp -16.05766867329450 OK ( 0.27 sec) - h2o_ot_precond_2.inp -16.06790080254980 OK ( 0.33 sec) - h2o_ot_precond_3.inp -16.02559849783376 OK ( 0.41 sec) - h2o_ot_precond_4.inp -15.85782186391538 OK ( 0.30 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-ot-refine-3 (28 of 45) done in 30.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/Fist/regtest-11 (29 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-ot-refine-3 + h2o_ot_lwdn_on_the_fly_l1.inp -17.13045715683766 OK ( 0.39 sec) + h2o_ot_poly_on_the_fly_l1.inp -17.13045715683766 OK ( 0.41 sec) + o2_ot_lwdn_on_the_fly_l1.inp -31.70815200232902 OK ( 0.66 sec) + o2_ot_poly_on_the_fly_l1.inp -31.70815200232900 OK ( 0.65 sec) + h2o_ot_refine_3.inp -17.08884672065215 OK ( 0.27 sec) + h2o_ot_refine_4.inp -17.11857283464191 OK ( 0.26 sec) + o2_ot_refine_3.inp -31.60858514413055 OK ( 0.41 sec) + o2_ot_refine_4.inp -31.58768162895354 OK ( 0.36 sec) + h2o_ot_precond_1.inp -16.05766867329450 OK ( 0.15 sec) + h2o_ot_precond_2.inp -16.06790080254981 OK ( 0.13 sec) + h2o_ot_precond_3.inp -16.02559849783376 OK ( 0.16 sec) + h2o_ot_precond_4.inp -15.85782186391538 OK ( 0.14 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-ot-refine-3 (28 of 45) done in 13.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/Fist/regtest-11 (29 of 45) Running H2O-32_NVT_CSVR_gen1.inp Running H2O-32_NVT_CSVR_gen2.inp Running H2O-32_NVT_CSVR_gen3.inp @@ -49776,151 +49811,151 @@ Running H2O-32_NVT_NOSE_gen_noCNS2.inp Running H2O-32_NVT_NOSE_gen_noCNS2_R.inp Running H2O-32_NVT_CSVR_gen_noCNS3.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/Fist/regtest-11 - H2O-32_NVT_CSVR_gen1.inp -0.609208076083E+00 OK ( 0.43 sec) - H2O-32_NVT_CSVR_gen2.inp -0.532133592588E+00 OK ( 0.47 sec) - H2O-32_NVT_CSVR_gen3.inp -0.500113893497E+00 OK ( 0.48 sec) - H2O-32_NVT_NOSE_gen_noCNS0.inp -0.492823650978E+00 OK ( 0.40 sec) - H2O-32_NVT_CSVR_gen_noCNS1.inp -0.509272888286E+00 OK ( 0.60 sec) - H2O-32_NVT_CSVR_gen_noCNS1_R.inp -0.458244617541E+00 OK ( 0.46 sec) - H2O-32_NVT_CSVR_gen_noCNS2.inp -0.505086327342E+00 OK ( 0.34 sec) - H2O-32_NVT_CSVR_gen_noCNS2_R.inp -0.448996689945E+00 OK ( 0.33 sec) - H2O-32_NVT_NOSE_gen_noCNS1.inp -0.495791635301E+00 OK ( 0.33 sec) - H2O-32_NVT_NOSE_gen_noCNS1_R.inp -0.494111874054E+00 OK ( 0.29 sec) - H2O-32_NVT_NOSE_gen_noCNS2.inp -0.484511068410E+00 OK ( 0.46 sec) - H2O-32_NVT_NOSE_gen_noCNS2_R.inp -0.470407397710E+00 OK ( 0.79 sec) - H2O-32_NVT_CSVR_gen_noCNS3.inp -0.505086327342E+00 OK ( 0.43 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/Fist/regtest-11 (29 of 45) done in 22.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-cdft-3-1 (30 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/Fist/regtest-11 + H2O-32_NVT_CSVR_gen1.inp -0.609208076083E+00 OK ( 0.28 sec) + H2O-32_NVT_CSVR_gen2.inp -0.532133592588E+00 OK ( 0.23 sec) + H2O-32_NVT_CSVR_gen3.inp -0.500113893497E+00 OK ( 0.23 sec) + H2O-32_NVT_NOSE_gen_noCNS0.inp -0.492823650978E+00 OK ( 0.27 sec) + H2O-32_NVT_CSVR_gen_noCNS1.inp -0.509272888286E+00 OK ( 0.26 sec) + H2O-32_NVT_CSVR_gen_noCNS1_R.inp -0.458244617541E+00 OK ( 0.27 sec) + H2O-32_NVT_CSVR_gen_noCNS2.inp -0.505086327342E+00 OK ( 0.29 sec) + H2O-32_NVT_CSVR_gen_noCNS2_R.inp -0.448996689945E+00 OK ( 0.26 sec) + H2O-32_NVT_NOSE_gen_noCNS1.inp -0.495791635301E+00 OK ( 0.29 sec) + H2O-32_NVT_NOSE_gen_noCNS1_R.inp -0.494111874054E+00 OK ( 0.25 sec) + H2O-32_NVT_NOSE_gen_noCNS2.inp -0.484511068410E+00 OK ( 0.29 sec) + H2O-32_NVT_NOSE_gen_noCNS2_R.inp -0.470407397710E+00 OK ( 0.28 sec) + H2O-32_NVT_CSVR_gen_noCNS3.inp -0.505086327342E+00 OK ( 0.26 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/Fist/regtest-11 (29 of 45) done in 13.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-cdft-3-1 (30 of 45) Running HeH-noconstraint.inp Running HeH-cdft-state-1.inp Running HeH-cdft-state-2-reversed.inp Running HeH-mixed-cdft-reversed-1.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-cdft-3-1 - HeH-noconstraint.inp -3.01067446615106 OK ( 3.04 sec) - HeH-cdft-state-1.inp 0.048406444583 OK ( 3.90 sec) - HeH-cdft-state-2-reversed.inp -1.819391902440 OK ( 4.09 sec) - HeH-mixed-cdft-reversed-1.inp 616.641603574190 OK ( 1.11 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-cdft-3-1 (30 of 45) done in 20.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/NEB/regtest-1 (31 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-cdft-3-1 + HeH-noconstraint.inp -3.01067446615106 OK ( 1.69 sec) + HeH-cdft-state-1.inp 0.048406444583 OK ( 2.12 sec) + HeH-cdft-state-2-reversed.inp -1.819391902440 OK ( 2.32 sec) + HeH-mixed-cdft-reversed-1.inp 616.641603574190 OK ( 0.62 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-cdft-3-1 (30 of 45) done in 10.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/NEB/regtest-1 (31 of 45) Running 2gly_B-NEB.inp Running 2gly_CI-NEB.inp Running 2gly_EB-NEB.inp Running 2gly_IT-NEB.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/NEB/regtest-1 - 2gly_B-NEB.inp -0.25722568775377 OK ( 1.54 sec) - 2gly_CI-NEB.inp -0.18925537289822 OK ( 1.74 sec) - 2gly_EB-NEB.inp 49.27319370383622 OK ( 1.35 sec) - 2gly_IT-NEB.inp 0.38518828458623 OK ( 1.36 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/NEB/regtest-1 (31 of 45) done in 13.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-pao-3 (32 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/NEB/regtest-1 + 2gly_B-NEB.inp -0.25722568775377 OK ( 1.18 sec) + 2gly_CI-NEB.inp -0.18925537289822 OK ( 1.18 sec) + 2gly_EB-NEB.inp 49.27319370383622 OK ( 1.19 sec) + 2gly_IT-NEB.inp 0.38518828458623 OK ( 0.95 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/NEB/regtest-1 (31 of 45) done in 8.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-pao-3 (32 of 45) Running He_ref.inp Running He_pao_initguess_exp.inp Running He_pao_initguess_fock.inp Running He_pao_initguess_rotinv.inp Running He_pao_initguess_gth.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-pao-3 - He_ref.inp -2.889334869153417 OK ( 1.32 sec) - He_pao_initguess_exp.inp -2.888972913350860 OK ( 0.75 sec) - He_pao_initguess_fock.inp -2.888972913350860 OK ( 0.78 sec) - He_pao_initguess_rotinv.inp -2.888972913350860 OK ( 0.73 sec) - He_pao_initguess_gth.inp -2.888972913350860 OK ( 0.73 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-pao-3 (32 of 45) done in 13.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/optimize_input/regtest-1 (33 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-pao-3 + He_ref.inp -2.889334869153418 OK ( 0.83 sec) + He_pao_initguess_exp.inp -2.888972913350860 OK ( 0.49 sec) + He_pao_initguess_fock.inp -2.888972913350860 OK ( 0.52 sec) + He_pao_initguess_rotinv.inp -2.888972913350860 OK ( 0.49 sec) + He_pao_initguess_gth.inp -2.888972913350860 OK ( 0.49 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-pao-3 (32 of 45) done in 7.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/optimize_input/regtest-1 (33 of 45) Running argon-ref.inp Running driver.inp Running driver-restart.inp Running driver-stride.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/optimize_input/regtest-1 - argon-ref.inp - OK ( 0.15 sec) - driver.inp 0.1072347063760515E+03 OK ( 0.62 sec) - driver-restart.inp 0.1076965059321605E+03 OK ( 1.42 sec) - driver-stride.inp 0.1072343388958498E+03 OK ( 0.35 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/optimize_input/regtest-1 (33 of 45) done in 10.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-properties/resp (34 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/optimize_input/regtest-1 + argon-ref.inp - OK ( 0.08 sec) + driver.inp 0.1072347063760515E+03 OK ( 0.36 sec) + driver-restart.inp 0.1076965059321590E+03 OK ( 0.57 sec) + driver-stride.inp 0.1072343388958498E+03 OK ( 0.20 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/optimize_input/regtest-1 (33 of 45) done in 5.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-properties/resp (34 of 45) Running CH3OH_nonperiodic.inp Running CH3OH_periodic.inp Running graphite.inp Running CH3OH_periodic_repeat.inp Running graphite_REPEAT.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-properties/resp - CH3OH_nonperiodic.inp 4.418290 OK ( 1.01 sec) - CH3OH_periodic.inp 2.456029 OK ( 0.78 sec) - graphite.inp -1.073313 OK ( 1.70 sec) - CH3OH_periodic_repeat.inp -4.871712 OK ( 0.81 sec) - graphite_REPEAT.inp 0.006058 OK ( 1.95 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-properties/resp (34 of 45) done in 16.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-nmr-2 (35 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-properties/resp + CH3OH_nonperiodic.inp 4.418290 OK ( 0.51 sec) + CH3OH_periodic.inp 2.456029 OK ( 0.42 sec) + graphite.inp -1.073313 OK ( 1.26 sec) + CH3OH_periodic_repeat.inp -4.871712 OK ( 0.42 sec) + graphite_REPEAT.inp 0.006058 OK ( 1.26 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-properties/resp (34 of 45) done in 8.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-nmr-2 (35 of 45) Running He_nmr_full.inp Running he2_bug_disp.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-nmr-2 - He_nmr_full.inp 0.198893E+03 OK ( 8.16 sec) - he2_bug_disp.inp 0.144732E+03 OK ( 1.61 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-nmr-2 (35 of 45) done in 14.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/SE/regtest-3-1 (36 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-nmr-2 + He_nmr_full.inp 0.198893E+03 OK ( 4.95 sec) + he2_bug_disp.inp 0.144732E+03 OK ( 1.10 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-nmr-2 (35 of 45) done in 9.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/SE/regtest-3-1 (36 of 45) Running H2O-MNDO-2.inp Running H-0.inp Running H2-0.inp Running H2.inp Running H2O-MNDO.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/SE/regtest-3-1 - H2O-MNDO-2.inp -351.42145109555827 OK ( 0.31 sec) - H-0.inp -0.319258384771667 OK ( 0.08 sec) - H2-0.inp -0.993280881213762 OK ( 0.15 sec) - H2.inp -0.037305167769230 OK ( 0.12 sec) - H2O-MNDO.inp -12.913048351744974 OK ( 1.25 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/SE/regtest-3-1 (36 of 45) done in 6.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-optbas (37 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/SE/regtest-3-1 + H2O-MNDO-2.inp -351.42145109555827 OK ( 0.28 sec) + H-0.inp -0.319258384771667 OK ( 0.06 sec) + H2-0.inp -0.993280881213762 OK ( 0.14 sec) + H2.inp -0.037305167769230 OK ( 0.11 sec) + H2O-MNDO.inp -12.913048351744974 OK ( 0.59 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/SE/regtest-3-1 (36 of 45) done in 5.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-optbas (37 of 45) Running H2O-ref.inp Running opt-1.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-optbas - H2O-ref.inp -17.02896604845323 OK ( 1.88 sec) - opt-1.inp -.46916008E+03 OK ( 5.51 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-optbas (37 of 45) done in 12.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-linearscaling (38 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-optbas + H2O-ref.inp -17.02896604845323 OK ( 1.42 sec) + opt-1.inp -.46916008E+03 OK ( 3.97 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-optbas (37 of 45) done in 8.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-linearscaling (38 of 45) Running test-shrt.inp Running w3-filter.inp Running w3-filter-2.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-linearscaling - test-shrt.inp - OK ( 0.95 sec) - w3-filter.inp -51.14051793253613 OK ( 1.52 sec) - w3-filter-2.inp -78.30555080313484 OK ( 0.49 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-linearscaling (38 of 45) done in 9.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/SWARM/regtest-glbopt-1 (39 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-linearscaling + test-shrt.inp - OK ( 0.58 sec) + w3-filter.inp -51.14051793253747 OK ( 0.83 sec) + w3-filter-2.inp -78.30555080313484 OK ( 0.32 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-linearscaling (38 of 45) done in 4.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/SWARM/regtest-glbopt-1 (39 of 45) Running LJ10_minhop_1.inp Running LJ10_minhop_2.inp Running LJ10_mincrawl_1.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/SWARM/regtest-glbopt-1 - LJ10_minhop_1.inp -0.26595092E-01 OK ( 0.98 sec) - LJ10_minhop_2.inp -0.28422123E-01 OK ( 0.36 sec) - LJ10_mincrawl_1.inp -0.28422151E-01 OK ( 3.93 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/SWARM/regtest-glbopt-1 (39 of 45) done in 11.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/TAMC/regtest (40 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/SWARM/regtest-glbopt-1 + LJ10_minhop_1.inp -0.26595092E-01 OK ( 0.30 sec) + LJ10_minhop_2.inp -0.28422123E-01 OK ( 0.23 sec) + LJ10_mincrawl_1.inp -0.28421922E-01 OK ( 1.04 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/SWARM/regtest-glbopt-1 (39 of 45) done in 4.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/TAMC/regtest (40 of 45) Running dimer.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/TAMC/regtest - dimer.inp -31.336010763980816 OK ( 4.97 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/TAMC/regtest (40 of 45) done in 8.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-lsroks (41 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/TAMC/regtest + dimer.inp -31.336010770093178 OK ( 4.22 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/TAMC/regtest (40 of 45) done in 6.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-lsroks (41 of 45) Running O2.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-lsroks - O2.inp -31.43642997434301 OK ( 3.46 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-lsroks (41 of 45) done in 6.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/QS/regtest-lrigpw (42 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-lsroks + O2.inp -31.43642997434300 OK ( 2.12 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-lsroks (41 of 45) done in 4.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/QS/regtest-lrigpw (42 of 45) Running C11H24-qmmm-gauss-0-lrigpw.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/QS/regtest-lrigpw - C11H24-qmmm-gauss-0-lrigpw.inp -28.00745026096900 OK ( 3.32 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QMMM/QS/regtest-lrigpw (42 of 45) done in 6.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/FE/regtest-2 (43 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/QS/regtest-lrigpw + C11H24-qmmm-gauss-0-lrigpw.inp -28.00745026097340 OK ( 1.88 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QMMM/QS/regtest-lrigpw (42 of 45) done in 3.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/FE/regtest-2 (43 of 45) Running Solv_alch_chng.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/FE/regtest-2 - Solv_alch_chng.inp -0.732003926645E+01 OK ( 4.84 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/FE/regtest-2 (43 of 45) done in 8.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-fftw (44 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/FE/regtest-2 + Solv_alch_chng.inp -0.732003926645E+01 OK ( 2.77 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/FE/regtest-2 (43 of 45) done in 5.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-fftw (44 of 45) Running H2-big-1.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-fftw - H2-big-1.inp -28.149134408983251 OK ( 1.77 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-fftw (44 of 45) done in 4.00 sec -Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-dm-ls-scf-4 (45 of 45) +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-fftw + H2-big-1.inp -28.149134408983251 OK ( 1.25 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-fftw (44 of 45) done in 3.00 sec +Starting regression tests in /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-dm-ls-scf-4 (45 of 45) Running H2O-dft-ls-DEFAULTS.inp Running H2O-dft-ls-NEWTONSCHULZ.inp Running H2O-dft-ls-PROOT3.inp @@ -49937,40 +49972,40 @@ Running H2O-dft-ls-SUBMATRIX-DIRECT.inp Running H2O-dft-ls-SUBMATRIX-DIRECT-MUADJ.inp Running H2O-dft-ls-SUBMATRIX-DIRECT-MUADJ-LOWMEM.inp ->>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-dm-ls-scf-4 - H2O-dft-ls-DEFAULTS.inp -17.031737705910469 OK ( 1.14 sec) - H2O-dft-ls-NEWTONSCHULZ.inp -17.031737705910469 OK ( 1.28 sec) - H2O-dft-ls-PROOT3.inp -17.031737715858107 OK ( 1.15 sec) - H2O-dft-ls-PROOT4.inp -17.031737702676047 OK ( 1.08 sec) - H2O-dft-ls-PROOT5.inp -17.031737600350329 OK ( 1.52 sec) - H2O-dft-ls-NEWTONSCHULZ3.inp -17.031737706154345 OK ( 1.36 sec) - H2O-dft-ls-NEWTONSCHULZ4.inp -17.031737706154345 OK ( 1.25 sec) - H2O-dft-ls-NEWTONSCHULZ5.inp -17.031737706154345 OK ( 1.22 sec) - H2O-dft-ls-NEWTONSCHULZ6.inp -17.031737706154274 OK ( 0.93 sec) - H2O-dft-ls-NEWTONSCHULZ7.inp -17.031737706160783 OK ( 0.96 sec) - H2O-dft-ls-NEWTONSCHULZ-SYMMETRIC.inp -17.031737705910469 OK ( 0.82 sec) - H2O-dft-ls-SUBMATRIX-NS.inp -17.031737705910469 OK ( 0.92 sec) - H2O-dft-ls-SUBMATRIX-NS3.inp -17.031737706154345 OK ( 1.04 sec) - H2O-dft-ls-SUBMATRIX-DIRECT.inp -17.031737706154345 OK ( 1.48 sec) - H2O-dft-ls-SUBMATRIX-DIRECT-MUADJ.inp -17.031737706154356 OK ( 1.12 sec) - H2O-dft-ls-SUBMATRIX-DIRECT-MUADJ-LOWMEM.inp -17.031737706154352 OK ( 1.41 sec) -<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/tests/QS/regtest-dm-ls-scf-4 (45 of 45) done in 41.00 sec +>>> /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-dm-ls-scf-4 + H2O-dft-ls-DEFAULTS.inp -17.031737705910469 OK ( 0.79 sec) + H2O-dft-ls-NEWTONSCHULZ.inp -17.031737705910469 OK ( 0.77 sec) + H2O-dft-ls-PROOT3.inp -17.031737715858107 OK ( 0.80 sec) + H2O-dft-ls-PROOT4.inp -17.031737702676047 OK ( 0.77 sec) + H2O-dft-ls-PROOT5.inp -17.031737600350329 OK ( 0.79 sec) + H2O-dft-ls-NEWTONSCHULZ3.inp -17.031737706154345 OK ( 0.76 sec) + H2O-dft-ls-NEWTONSCHULZ4.inp -17.031737706154345 OK ( 0.79 sec) + H2O-dft-ls-NEWTONSCHULZ5.inp -17.031737706154345 OK ( 0.80 sec) + H2O-dft-ls-NEWTONSCHULZ6.inp -17.031737706154274 OK ( 0.80 sec) + H2O-dft-ls-NEWTONSCHULZ7.inp -17.031737706160783 OK ( 0.78 sec) + H2O-dft-ls-NEWTONSCHULZ-SYMMETRIC.inp -17.031737705910469 OK ( 0.78 sec) + H2O-dft-ls-SUBMATRIX-NS.inp -17.031737705910469 OK ( 0.81 sec) + H2O-dft-ls-SUBMATRIX-NS3.inp -17.031737706154345 OK ( 0.79 sec) + H2O-dft-ls-SUBMATRIX-DIRECT.inp -17.031737706154345 OK ( 0.78 sec) + H2O-dft-ls-SUBMATRIX-DIRECT-MUADJ.inp -17.031737706154356 OK ( 0.78 sec) + H2O-dft-ls-SUBMATRIX-DIRECT-MUADJ-LOWMEM.inp -17.031737706154352 OK ( 0.78 sec) +<<< /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/tests/QS/regtest-dm-ls-scf-4 (45 of 45) done in 24.00 sec -------------------------------------------------------------------------- -------------------------------------------------------------------------- - regtesting location summary file: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/summary.txt - regtesting location error_summary file: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/error_summary - regtesting location memory_summary file: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12/memory_summary - regtesting location output dir: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2024-01-07_05-29-12 + regtesting location summary file: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/summary.txt + regtesting location error_summary file: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/error_summary + regtesting location memory_summary file: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58/memory_summary + regtesting location output dir: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//TEST-Linux-x86_64-gfortran-psmp-2025-02-09_16-23-58 regtesting location last dir: /build/reproducible-path/cp2k-8.1/tools/regtesting/../..//LAST-Linux-x86_64-gfortran-psmp --------------------------------- Timings -------------------------------- Plot: name="timings", title="Timing Distribution", ylabel="time [s]" -PlotPoint: name="100th_percentile", plot="timings", label="100th %ile", y=55.46, yerr=0.0 -PlotPoint: name="99th_percentile", plot="timings", label="99th %ile", y=35.081399999999874, yerr=0.0 -PlotPoint: name="98th_percentile", plot="timings", label="98th %ile", y=29.439600000000013, yerr=0.0 -PlotPoint: name="95th_percentile", plot="timings", label="95th %ile", y=15.888999999999992, yerr=0.0 -PlotPoint: name="90th_percentile", plot="timings", label="90th %ile", y=9.606000000000007, yerr=0.0 -PlotPoint: name="80th_percentile", plot="timings", label="80th %ile", y=4.346000000000001, yerr=0.0 +PlotPoint: name="100th_percentile", plot="timings", label="100th %ile", y=27.53, yerr=0.0 +PlotPoint: name="99th_percentile", plot="timings", label="99th %ile", y=21.030999999999946, yerr=0.0 +PlotPoint: name="98th_percentile", plot="timings", label="98th %ile", y=14.189600000000004, yerr=0.0 +PlotPoint: name="95th_percentile", plot="timings", label="95th %ile", y=11.159999999999998, yerr=0.0 +PlotPoint: name="90th_percentile", plot="timings", label="90th %ile", y=6.262000000000004, yerr=0.0 +PlotPoint: name="80th_percentile", plot="timings", label="80th %ile", y=2.7860000000000005, yerr=0.0 --------------------------------- Summary -------------------------------- Number of FAILED tests 0 @@ -49979,20 +50014,20 @@ Total number of tests 367 GREPME 0 0 367 0 367 X -Summary: correct: 367 / 367; 31min +Summary: correct: 367 / 367; 18min Status: OK -------------------------------------------------------------------------- -Regtest took 1878.00 seconds. +Regtest took 1088.00 seconds. -------------------------------------------------------------------------- -Sun Jan 7 06:00:29 -12 2024 +Sun Feb 9 16:42:05 +14 2025 *************************** testing ended ******************************** make[1]: Leaving directory '/build/reproducible-path/cp2k-8.1' create-stamp debian/debhelper-build-stamp dh_prep dh_installdirs dh_auto_install - make -j15 install DESTDIR=/build/reproducible-path/cp2k-8.1/debian/tmp AM_UPDATE_INFO_DIR=no + make -j16 install DESTDIR=/build/reproducible-path/cp2k-8.1/debian/tmp AM_UPDATE_INFO_DIR=no make[1]: Entering directory '/build/reproducible-path/cp2k-8.1' Discovering programs ... Makefile:280: target 'install' does not exist @@ -50031,12 +50066,14 @@ dpkg-buildpackage: info: binary-only upload (no source included) dpkg-genchanges: info: not including original source code in upload I: copying local configuration +I: user script /srv/workspace/pbuilder/773568/tmp/hooks/B01_cleanup starting +I: user script /srv/workspace/pbuilder/773568/tmp/hooks/B01_cleanup finished I: unmounting dev/ptmx filesystem I: unmounting dev/pts filesystem I: unmounting dev/shm filesystem I: unmounting proc filesystem I: unmounting sys filesystem I: cleaning the build env -I: removing directory /srv/workspace/pbuilder/3750649 and its subdirectories -I: Current time: Sun Jan 7 06:02:51 -12 2024 -I: pbuilder-time-stamp: 1704650571 +I: removing directory /srv/workspace/pbuilder/773568 and its subdirectories +I: Current time: Sun Feb 9 16:43:20 +14 2025 +I: pbuilder-time-stamp: 1739069000