Diff of the two buildlogs: -- --- b1/build.log 2024-12-09 03:41:11.211399229 +0000 +++ b2/build.log 2024-12-09 03:42:21.980198399 +0000 @@ -1,6 +1,6 @@ I: pbuilder: network access will be disabled during build -I: Current time: Sun Dec 8 15:37:12 -12 2024 -I: pbuilder-time-stamp: 1733715432 +I: Current time: Mon Jan 12 00:04:13 +14 2026 +I: pbuilder-time-stamp: 1768125853 I: Building the build Environment I: extracting base tarball [/var/cache/pbuilder/unstable-reproducible-base.tgz] I: copying local configuration @@ -25,52 +25,84 @@ dpkg-source: info: unpacking libgridxc_2.0.2-1.debian.tar.xz I: using fakeroot in build. I: Installing the build-deps -I: user script /srv/workspace/pbuilder/818019/tmp/hooks/D02_print_environment starting +I: user script /srv/workspace/pbuilder/1082461/tmp/hooks/D01_modify_environment starting +debug: Running on ionos5-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 Jan 11 10:04 /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/1082461/tmp/hooks/D01_modify_environment finished +I: user script /srv/workspace/pbuilder/1082461/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 parallel=20 ' - DISTRIBUTION='unstable' - HOME='/root' - HOST_ARCH='amd64' + BASH=/bin/sh + BASHOPTS=checkwinsize:cmdhist:complete_fullquote:extquote:force_fignore:globasciiranges:globskipdots:hostcomplete:interactive_comments:patsub_replacement:progcomp:promptvars:sourcepath + BASH_ALIASES=() + BASH_ARGC=() + BASH_ARGV=() + BASH_CMDS=() + BASH_LINENO=([0]="12" [1]="0") + BASH_LOADABLES_PATH=/usr/local/lib/bash:/usr/lib/bash:/opt/local/lib/bash:/usr/pkg/lib/bash:/opt/pkg/lib/bash:. + BASH_SOURCE=([0]="/tmp/hooks/D02_print_environment" [1]="/tmp/hooks/D02_print_environment") + BASH_VERSINFO=([0]="5" [1]="2" [2]="37" [3]="1" [4]="release" [5]="x86_64-pc-linux-gnu") + BASH_VERSION='5.2.37(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 parallel=42 ' + DIRSTACK=() + DISTRIBUTION=unstable + EUID=0 + FUNCNAME=([0]="Echo" [1]="main") + GROUPS=() + HOME=/root + HOSTNAME=i-capture-the-hostname + HOSTTYPE=x86_64 + HOST_ARCH=amd64 IFS=' ' - INVOCATION_ID='b5cf40f9098b45afb2b2e0145d15c5d4' - 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='818019' - PS1='# ' - PS2='> ' + INVOCATION_ID=910e2f82c16c484da9167a2af1460438 + 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=1082461 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.qmcaJINf/pbuilderrc_tKaI --distribution unstable --hookdir /etc/pbuilder/first-build-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/unstable-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.qmcaJINf/b1 --logfile b1/build.log libgridxc_2.0.2-1.dsc' - SUDO_GID='110' - SUDO_UID='105' - SUDO_USER='jenkins' - TERM='unknown' - TZ='/usr/share/zoneinfo/Etc/GMT+12' - USER='root' - _='/usr/bin/systemd-run' - http_proxy='http://46.16.76.132:3128' + 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.qmcaJINf/pbuilderrc_E3mg --distribution unstable --hookdir /etc/pbuilder/rebuild-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/unstable-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.qmcaJINf/b2 --logfile b2/build.log libgridxc_2.0.2-1.dsc' + SUDO_GID=110 + SUDO_UID=105 + SUDO_USER=jenkins + TERM=unknown + TZ=/usr/share/zoneinfo/Etc/GMT-14 + UID=0 + USER=root + _='I: set' + http_proxy=http://213.165.73.152:3128 I: uname -a - Linux ionos1-amd64 6.1.0-28-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.1.119-1 (2024-11-22) x86_64 GNU/Linux + Linux i-capture-the-hostname 6.11.5+bpo-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.11.5-1~bpo12+1 (2024-11-11) x86_64 GNU/Linux I: ls -l /bin - lrwxrwxrwx 1 root root 7 Nov 22 14:40 /bin -> usr/bin -I: user script /srv/workspace/pbuilder/818019/tmp/hooks/D02_print_environment finished + lrwxrwxrwx 1 root root 7 Nov 22 2024 /bin -> usr/bin +I: user script /srv/workspace/pbuilder/1082461/tmp/hooks/D02_print_environment finished -> Attempting to satisfy build-dependencies -> Creating pbuilder-satisfydepends-dummy package Package: pbuilder-satisfydepends-dummy @@ -179,7 +211,7 @@ Get: 63 http://deb.debian.org/debian unstable/main amd64 pkgconf-bin amd64 1.8.1-4 [30.2 kB] Get: 64 http://deb.debian.org/debian unstable/main amd64 pkgconf amd64 1.8.1-4 [26.2 kB] Get: 65 http://deb.debian.org/debian unstable/main amd64 pkg-config amd64 1.8.1-4 [14.0 kB] -Fetched 62.9 MB in 3s (24.3 MB/s) +Fetched 62.9 MB in 4s (16.0 MB/s) debconf: delaying package configuration, since apt-utils is not installed Selecting previously unselected package libproc2-0:amd64. (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 ... 19965 files and directories currently installed.) @@ -461,7 +493,11 @@ fakeroot is already the newest version (1.36-1). 0 upgraded, 0 newly installed, 0 to remove and 0 not upgraded. I: Building the package -I: Running cd /build/reproducible-path/libgridxc-2.0.2/ && 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 > ../libgridxc_2.0.2-1_source.changes +I: user script /srv/workspace/pbuilder/1082461/tmp/hooks/A99_set_merged_usr starting +Not re-configuring usrmerge for unstable +I: user script /srv/workspace/pbuilder/1082461/tmp/hooks/A99_set_merged_usr finished +hostname: Name or service not known +I: Running cd /build/reproducible-path/libgridxc-2.0.2/ && 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 > ../libgridxc_2.0.2-1_source.changes dpkg-buildpackage: info: source package libgridxc dpkg-buildpackage: info: source version 2.0.2-1 dpkg-buildpackage: info: source distribution unstable @@ -518,8 +554,8 @@ -- Searching for libXC library - found -- Configuring docs -- Configuring libgridxc tests... --- Configuring done (3.3s) --- Generating done (0.3s) +-- Configuring done (0.5s) +-- Generating done (0.0s) CMake Warning: Manually-specified variables were not used by the project: @@ -531,7 +567,7 @@ -- Build files have been written to: /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2' dh_auto_build -O--buildsystem=cmake - cd obj-x86_64-linux-gnu && make -j20 "INSTALL=install --strip-program=true" VERBOSE=1 + cd obj-x86_64-linux-gnu && make -j42 "INSTALL=install --strip-program=true" VERBOSE=1 make[1]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' /usr/bin/cmake -S/build/reproducible-path/libgridxc-2.0.2 -B/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu --check-build-system CMakeFiles/Makefile.cmake 0 /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/CMakeFiles /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu//CMakeFiles/progress.marks @@ -546,68 +582,68 @@ make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' make -f CMakeFiles/libgridxc-lib.dir/build.make CMakeFiles/libgridxc-lib.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -[ 3%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/alloc.F90.o -[ 3%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/gridxc_config.F90.o -/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/alloc.F90 -o CMakeFiles/libgridxc-lib.dir/src/alloc.F90.o -/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/gridxc_config.F90 -o CMakeFiles/libgridxc-lib.dir/src/gridxc_config.F90.o -[ 5%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/sys.F90.o -[ 7%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/precision.F90.o +[ 1%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/sys.F90.o +[ 5%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/precision.F90.o +[ 5%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/alloc.F90.o +[ 7%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/gridxc_config.F90.o [ 9%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/m_walltime.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/precision.F90 -o CMakeFiles/libgridxc-lib.dir/src/precision.F90.o +/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/alloc.F90 -o CMakeFiles/libgridxc-lib.dir/src/alloc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/sys.F90 -o CMakeFiles/libgridxc-lib.dir/src/sys.F90.o +/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/gridxc_config.F90 -o CMakeFiles/libgridxc-lib.dir/src/gridxc_config.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 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touch CMakeFiles/libgridxc-lib.dir/src/gridxc_config.F90.o.provides.build [ 11%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/xc_xwpbe.F90.o -/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/xc_xwpbe.F90 -o CMakeFiles/libgridxc-lib.dir/src/xc_xwpbe.F90.o +[ 13%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/sorting.F90.o [ 15%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/cellsubs.F90.o -[ 15%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/sorting.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_sys.mod CMakeFiles/libgridxc-lib.dir/gridxc_sys.mod.stamp GNU -/usr/bin/f95 -DHAVE_LIBXC 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-fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/cellsubs.F90 -o CMakeFiles/libgridxc-lib.dir/src/cellsubs.F90.o +/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/sorting.F90 -o CMakeFiles/libgridxc-lib.dir/src/sorting.F90.o /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/m_walltime.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/sys.F90.o.provides.build -/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_cellsubs.mod CMakeFiles/libgridxc-lib.dir/gridxc_cellsubs.mod.stamp GNU -[ 17%] Building Fortran object 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-ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/interpolation.F90 -o CMakeFiles/libgridxc-lib.dir/src/interpolation.F90.o -[ 25%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/am05.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/am05.F90 -o CMakeFiles/libgridxc-lib.dir/src/am05.F90.o -[ 29%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/array.F90.o +[ 25%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/array.F90.o +[ 25%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/ldaxc.F90.o +[ 25%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/bessph.F90.o +/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/interpolation.F90 -o CMakeFiles/libgridxc-lib.dir/src/interpolation.F90.o +[ 27%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/m_io.F90.o +/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/ldaxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/ldaxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/array.F90 -o CMakeFiles/libgridxc-lib.dir/src/array.F90.o +[ 29%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/gridxc_fft_gpfa.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/bessph.F90 -o CMakeFiles/libgridxc-lib.dir/src/bessph.F90.o -/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/gridxc_fft_gpfa.F90 -o CMakeFiles/libgridxc-lib.dir/src/gridxc_fft_gpfa.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/m_io.F90 -o CMakeFiles/libgridxc-lib.dir/src/m_io.F90.o +/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/gridxc_fft_gpfa.F90 -o CMakeFiles/libgridxc-lib.dir/src/gridxc_fft_gpfa.F90.o +/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_cellsubs.mod CMakeFiles/libgridxc-lib.dir/gridxc_cellsubs.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/cellsubs.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_bessph.mod CMakeFiles/libgridxc-lib.dir/gridxc_bessph.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/bessph.F90.o.provides.build -/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_sorting.mod CMakeFiles/libgridxc-lib.dir/gridxc_sorting.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_io.mod CMakeFiles/libgridxc-lib.dir/gridxc_io.mod.stamp GNU +/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/m_io.F90.o.provides.build +/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_sorting.mod CMakeFiles/libgridxc-lib.dir/gridxc_sorting.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/sorting.F90.o.provides.build [ 31%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/minvec.F90.o -/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/m_io.F90.o.provides.build /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/minvec.F90 -o CMakeFiles/libgridxc-lib.dir/src/minvec.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_am05.mod CMakeFiles/libgridxc-lib.dir/gridxc_am05.mod.stamp GNU -/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_minvec.mod CMakeFiles/libgridxc-lib.dir/gridxc_minvec.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/am05.F90.o.provides.build +/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_minvec.mod CMakeFiles/libgridxc-lib.dir/gridxc_minvec.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_lda.mod CMakeFiles/libgridxc-lib.dir/gridxc_lda.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/minvec.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/ldaxc.F90.o.provides.build [ 33%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/chkgmx.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/chkgmx.F90 -o CMakeFiles/libgridxc-lib.dir/src/chkgmx.F90.o -/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_chkgmx.mod CMakeFiles/libgridxc-lib.dir/gridxc_chkgmx.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_interpolation.mod CMakeFiles/libgridxc-lib.dir/gridxc_interpolation.mod.stamp GNU -/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/chkgmx.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/interpolation.F90.o.provides.build +/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_chkgmx.mod CMakeFiles/libgridxc-lib.dir/gridxc_chkgmx.mod.stamp GNU [ 35%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/mesh1d.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/mesh1d.F90 -o CMakeFiles/libgridxc-lib.dir/src/mesh1d.F90.o +/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/chkgmx.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_array.mod CMakeFiles/libgridxc-lib.dir/gridxc_array.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/array.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_mesh1d.mod CMakeFiles/libgridxc-lib.dir/gridxc_mesh1d.mod.stamp GNU @@ -616,20 +652,20 @@ /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/xc_xwpbe.F90.o.provides.build [ 37%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/xc_hybrids.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/xc_hybrids.F90 -o CMakeFiles/libgridxc-lib.dir/src/xc_hybrids.F90.o +/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_hybrids.mod CMakeFiles/libgridxc-lib.dir/gridxc_hybrids.mod.stamp GNU +/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/xc_hybrids.F90.o.provides.build +[ 39%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/ggaxc.F90.o +/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/ggaxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/ggaxc.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_alloc.mod CMakeFiles/libgridxc-lib.dir/gridxc_alloc.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/alloc.F90.o.provides.build -[ 39%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/mesh3d.F90.o +[ 41%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/mesh3d.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/mesh3d.F90 -o CMakeFiles/libgridxc-lib.dir/src/mesh3d.F90.o -[ 41%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/moreParallelSubs.F90.o +[ 43%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/moreParallelSubs.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/moreParallelSubs.F90 -o CMakeFiles/libgridxc-lib.dir/src/moreParallelSubs.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_moreparallelsubs.mod CMakeFiles/libgridxc-lib.dir/gridxc_moreparallelsubs.mod.stamp GNU -/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_hybrids.mod CMakeFiles/libgridxc-lib.dir/gridxc_hybrids.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/moreParallelSubs.F90.o.provides.build -[ 43%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/debugxc.F90.o +[ 45%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/debugxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/debugxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/debugxc.F90.o -/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/xc_hybrids.F90.o.provides.build -[ 45%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/ggaxc.F90.o -/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/ggaxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/ggaxc.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_debugxc.mod CMakeFiles/libgridxc-lib.dir/gridxc_debugxc.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/debugxc.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_gga.mod CMakeFiles/libgridxc-lib.dir/gridxc_gga.mod.stamp GNU @@ -664,8 +700,8 @@ /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/xcmod.F90 -o CMakeFiles/libgridxc-lib.dir/src/xcmod.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_xcmod.mod CMakeFiles/libgridxc-lib.dir/gridxc_xcmod.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/xcmod.F90.o.provides.build -[ 58%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o [ 60%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/cellxc.F90.o +[ 60%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/cellxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/cellxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/atomxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_atom.mod CMakeFiles/libgridxc-lib.dir/gridxc_atom.mod.stamp GNU @@ -675,8 +711,8 @@ [ 62%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/gridxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/gridxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/gridxc.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc.mod CMakeFiles/libgridxc-lib.dir/gridxc.mod.stamp GNU -/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/gridxc.F90.o.provides.build [ 64%] Linking Fortran static library libgridxc.a +/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/gridxc.F90.o.provides.build /usr/bin/cmake -P CMakeFiles/libgridxc-lib.dir/cmake_clean_target.cmake /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-lib.dir/link.txt --verbose=1 /usr/bin/ar qc libgridxc.a "CMakeFiles/libgridxc-lib.dir/src/alloc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/am05.F90.o" "CMakeFiles/libgridxc-lib.dir/src/array.F90.o" "CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/bessph.F90.o" "CMakeFiles/libgridxc-lib.dir/src/cellsubs.F90.o" "CMakeFiles/libgridxc-lib.dir/src/cellxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/chkgmx.F90.o" "CMakeFiles/libgridxc-lib.dir/src/debugxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/fft3d.F90.o" "CMakeFiles/libgridxc-lib.dir/src/fftr.F90.o" "CMakeFiles/libgridxc-lib.dir/src/ggaxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/gridxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/gridxc_config.F90.o" "CMakeFiles/libgridxc-lib.dir/src/gridxc_fft_gpfa.F90.o" "CMakeFiles/libgridxc-lib.dir/src/interpolation.F90.o" "CMakeFiles/libgridxc-lib.dir/src/ldaxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/m_io.F90.o" "CMakeFiles/libgridxc-lib.dir/src/m_walltime.F90.o" "CMakeFiles/libgridxc-lib.dir/src/mesh1d.F90.o" "CMakeFiles/libgridxc-lib.dir/src/mesh3d.F90.o" "CMakeFiles/libgridxc-lib.dir/src/minvec.F90.o" "CMakeFiles/libgridxc-lib.dir/src/moreParallelSubs.F90.o" "CMakeFiles/libgridxc-lib.dir/src/precision.F90.o" "CMakeFiles/libgridxc-lib.dir/src/radfft.F90.o" "CMakeFiles/libgridxc-lib.dir/src/sorting.F90.o" "CMakeFiles/libgridxc-lib.dir/src/sys.F90.o" "CMakeFiles/libgridxc-lib.dir/src/vdwxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/vv_vdwxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/xc_hybrids.F90.o" "CMakeFiles/libgridxc-lib.dir/src/xc_xwpbe.F90.o" "CMakeFiles/libgridxc-lib.dir/src/xcmod.F90.o" @@ -685,156 +721,156 @@ [ 64%] Built target libgridxc-lib make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/depend make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/depend -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/DependInfo.cmake "--color=" -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/DependInfo.cmake "--color=" make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/depend make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/depend -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/DependInfo.cmake "--color=" +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/depend -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/DependInfo.cmake "--color=" -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/DependInfo.cmake "--color=" +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/DependInfo.cmake "--color=" make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/DependInfo.cmake "--color=" make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/depend +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/DependInfo.cmake "--color=" +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/DependInfo.cmake "--color=" make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/DependInfo.cmake "--color=" +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/depend.internal". cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake "--color=" -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/depend.internal". +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/depend.internal". -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/DependInfo.cmake "--color=" -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/DependInfo.cmake "--color=" +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/depend.internal". +Scanning dependencies of target libgridxc-test2 +Scanning dependencies of target libgridxc-test1 Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/depend.internal". -Scanning dependencies of target libgridxc-test3 -Scanning dependencies of target libgridxc-test1 -Scanning dependencies of target libgridxc-test2 Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/depend.internal". -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/build -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/build -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/build +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/depend.internal". +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/depend.internal". -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend.internal". -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/depend.internal". -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/depend.internal". -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/depend.internal". -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/depend.internal". -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/build Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/depend.internal". -Scanning dependencies of target libgridxc-test_match +Scanning dependencies of target libgridxc-test_libxc +Scanning dependencies of target libgridxc-test6 Scanning dependencies of target libgridxc-test4 +Scanning dependencies of target libgridxc-test_libxc2 +Scanning dependencies of target libgridxc-test3 +make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/build +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/depend.internal". +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/depend.internal". +Scanning dependencies of target libgridxc-test_match +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' Scanning dependencies of target libgridxc-test_hse06 +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -Scanning dependencies of target libgridxc-test_libxc -make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -Scanning dependencies of target libgridxc-test_libxc2 -Scanning dependencies of target libgridxc-test6 +make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -[ 66%] Building Fortran object Testers/CMakeFiles/libgridxc-test2.dir/test2.F90.o -[ 68%] Building Fortran object Testers/CMakeFiles/libgridxc-test1.dir/test1.f90.o make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/build -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test1.f90 -o CMakeFiles/libgridxc-test1.dir/test1.f90.o -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test2.F90 -o CMakeFiles/libgridxc-test2.dir/test2.F90.o make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/build -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -[ 70%] Building Fortran object Testers/CMakeFiles/libgridxc-test3.dir/test3.F90.o -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test3.F90 -o CMakeFiles/libgridxc-test3.dir/test3.F90.o make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -[ 72%] Building Fortran object Testers/CMakeFiles/libgridxc-test4.dir/test4.F90.o -[ 74%] Building Fortran object Testers/CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +[ 66%] Building Fortran object Testers/CMakeFiles/libgridxc-test2.dir/test2.F90.o +[ 68%] Building Fortran object Testers/CMakeFiles/libgridxc-test1.dir/test1.f90.o +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test2.F90 -o CMakeFiles/libgridxc-test2.dir/test2.F90.o +[ 70%] Building Fortran object Testers/CMakeFiles/libgridxc-test3.dir/test3.F90.o +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test1.f90 -o CMakeFiles/libgridxc-test1.dir/test1.f90.o +[ 74%] Building Fortran object Testers/CMakeFiles/libgridxc-test6.dir/test6.f90.o +[ 74%] Building Fortran object Testers/CMakeFiles/libgridxc-test4.dir/test4.F90.o +[ 76%] Building Fortran object Testers/CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test3.F90 -o CMakeFiles/libgridxc-test3.dir/test3.F90.o +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test6.f90 -o CMakeFiles/libgridxc-test6.dir/test6.f90.o cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test4.F90 -o CMakeFiles/libgridxc-test4.dir/test4.F90.o -[ 76%] Building Fortran object Testers/CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o +[ 78%] Building Fortran object Testers/CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o +[ 80%] Building Fortran object Testers/CMakeFiles/libgridxc-test_match.dir/test_match.F90.o cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test_libxc.F90 -o CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o +[ 82%] Building Fortran object Testers/CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test_libxc2.F90 -o CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o -[ 78%] Building Fortran object Testers/CMakeFiles/libgridxc-test6.dir/test6.f90.o -[ 80%] Building Fortran object Testers/CMakeFiles/libgridxc-test_match.dir/test_match.F90.o -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test6.f90 -o CMakeFiles/libgridxc-test6.dir/test6.f90.o cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test_match.F90 -o CMakeFiles/libgridxc-test_match.dir/test_match.F90.o -[ 82%] Building Fortran object Testers/CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test_hse06.F90 -o CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o -[ 84%] Linking Fortran executable libgridxc-test6 -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test6.dir/link.txt --verbose=1 -[ 86%] Linking Fortran executable libgridxc-test2 -[ 88%] Linking Fortran executable libgridxc-test_libxc2 -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test2.dir/link.txt --verbose=1 -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_libxc2.dir/link.txt --verbose=1 -[ 90%] Linking Fortran executable libgridxc-test_match +[ 86%] Linking Fortran executable libgridxc-test_hse06 +[ 86%] Linking Fortran executable libgridxc-test_match cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_match.dir/link.txt --verbose=1 -[ 92%] Linking Fortran executable libgridxc-test_hse06 cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_hse06.dir/link.txt --verbose=1 -[ 94%] Linking Fortran executable libgridxc-test4 -[ 96%] Linking Fortran executable libgridxc-test1 -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test4.dir/link.txt --verbose=1 -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test1.dir/link.txt --verbose=1 -[ 98%] Linking Fortran executable libgridxc-test3 -[100%] Linking Fortran executable libgridxc-test_libxc -/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test1.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test1.dir/test1.f90.o" -o libgridxc-test1 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so +[ 88%] Linking Fortran executable libgridxc-test_libxc cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_libxc.dir/link.txt --verbose=1 +[ 90%] Linking Fortran executable libgridxc-test_libxc2 +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_libxc2.dir/link.txt --verbose=1 +[ 92%] Linking Fortran executable libgridxc-test2 +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test2.dir/link.txt --verbose=1 +/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test_hse06.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o" -o libgridxc-test_hse06 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so +/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test_match.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test_match.dir/test_match.F90.o" -o libgridxc-test_match ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test3.dir/link.txt --verbose=1 +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +[ 94%] Linking Fortran executable libgridxc-test6 +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test6.dir/link.txt --verbose=1 +[ 94%] Built target libgridxc-test_match +[ 94%] Built target libgridxc-test_hse06 +/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test_libxc.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o" -o libgridxc-test_libxc ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test_libxc2.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o" -o libgridxc-test_libxc2 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so -/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test2.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test2.dir/test2.F90.o" -o libgridxc-test2 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test_hse06.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o" -o libgridxc-test_hse06 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test2.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test2.dir/test2.F90.o" -o libgridxc-test2 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so +[ 94%] Built target libgridxc-test_libxc +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +[ 94%] Built target libgridxc-test_libxc2 +[ 94%] Built target libgridxc-test2 /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test6.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test6.dir/test6.f90.o" -o libgridxc-test6 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +[ 94%] Built target libgridxc-test6 +[ 96%] Linking Fortran executable libgridxc-test4 +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test4.dir/link.txt --verbose=1 +[ 98%] Linking Fortran executable libgridxc-test1 +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test1.dir/link.txt --verbose=1 +/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test4.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test4.dir/test4.F90.o" -o libgridxc-test4 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test_match.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test_match.dir/test_match.F90.o" -o libgridxc-test_match ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so +[ 98%] Built target libgridxc-test4 +/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test1.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test1.dir/test1.f90.o" -o libgridxc-test1 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -[100%] Built target libgridxc-test_libxc2 -[100%] Built target libgridxc-test1 -[100%] Built target libgridxc-test6 -[100%] Built target libgridxc-test2 +[ 98%] Built target libgridxc-test1 +[100%] Linking Fortran executable libgridxc-test3 +cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test3.dir/link.txt --verbose=1 /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test3.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test3.dir/test3.F90.o" -o libgridxc-test3 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so -/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test_libxc.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o" -o libgridxc-test_libxc ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -/usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file,CMakeFiles/libgridxc-test4.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test4.dir/test4.F90.o" -o libgridxc-test4 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -[100%] Built target libgridxc-test4 -[100%] Built target libgridxc-test_hse06 -[100%] Built target libgridxc-test_match [100%] Built target libgridxc-test3 -[100%] Built target libgridxc-test_libxc make[2]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/CMakeFiles 0 make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' dh_auto_test -O--buildsystem=cmake - cd obj-x86_64-linux-gnu && make -j20 test ARGS\+=--verbose ARGS\+=-j20 + cd obj-x86_64-linux-gnu && make -j42 test ARGS\+=--verbose ARGS\+=-j42 make[1]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' Running tests... -/usr/bin/ctest --force-new-ctest-process --verbose -j20 +/usr/bin/ctest --force-new-ctest-process --verbose -j42 UpdateCTestConfiguration from :/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/DartConfiguration.tcl UpdateCTestConfiguration from :/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/DartConfiguration.tcl Test project /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu @@ -1736,62 +1772,6 @@ 6: 1 2.600 0.020455616 -0.776561113 -0.776561113 -0.000000000 6: 1 2.800 0.017872394 -0.746026275 -0.746026272 -0.000000003 6: 1 3.000 0.015460016 -0.714697437 -0.714697435 -0.000000002 -6: 1 3.200 0.013240188 -0.682792452 -0.682792453 0.000000001 -6: 1 3.400 0.011226266 -0.650510776 -0.650510773 -0.000000003 -6: 1 3.600 0.009423960 -0.618021733 -0.618021733 0.000000001 -6: 1 3.800 0.007832284 -0.585445444 -0.585445445 0.000000001 -6: 1 4.000 0.006444664 -0.552823710 -0.552823709 -0.000000001 -6: 1 4.200 0.005250115 -0.520082870 -0.520082870 0.000000001 -6: 1 4.400 0.004234421 -0.487004137 -0.487004139 0.000000002 -6: 1 4.600 0.003381238 -0.453240679 -0.453240680 0.000000001 -6: 1 4.800 0.002673091 -0.418441530 -0.418441528 -0.000000002 -6: 1 5.000 0.002092223 -0.382520889 -0.382520888 -0.000000001 -6: 1 5.200 0.001621280 -0.346003183 -0.346003181 -0.000000002 -6: 1 5.400 0.001243837 -0.310216436 -0.310216435 -0.000000000 -6: 1 5.600 0.000944766 -0.277074102 -0.277074102 -0.000000001 -6: 1 5.800 0.000710460 -0.248426892 -0.248426893 0.000000001 -6: 1 6.000 0.000528944 -0.225324029 -0.225324030 0.000000002 -6: 1 6.200 0.000389881 -0.207630641 -0.207630643 0.000000002 -6: 1 6.400 0.000284517 -0.194187231 -0.194187233 0.000000002 -6: 1 6.600 0.000205559 -0.183339501 -0.183339503 0.000000001 -6: 1 6.800 0.000147033 -0.173510692 -0.173510693 0.000000002 -6: 1 7.000 0.000104122 -0.163573430 -0.163573432 0.000000002 -6: 1 7.200 0.000072999 -0.152957536 -0.152957539 0.000000003 -6: 1 7.400 0.000050669 -0.141563831 -0.141563836 0.000000005 -6: 1 7.600 0.000034818 -0.129595146 -0.129595152 0.000000006 -6: 1 7.800 0.000023687 -0.117391049 -0.117391056 0.000000007 -6: 1 8.000 0.000015954 -0.105308033 -0.105308040 0.000000007 -6: 1 8.200 0.000010638 -0.093651613 -0.093651624 0.000000011 -6: 1 8.400 0.000007022 -0.082649174 -0.082649186 0.000000012 -6: 1 8.600 0.000004589 -0.072448262 -0.072448275 0.000000013 -6: 1 8.800 0.000002969 -0.063127570 -0.063127580 0.000000010 -6: 1 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0.031746818 -0.920374352 -6: 2 0.200 0.031588480 -0.919313228 -0.919312954 -0.000000274 -6: 2 0.400 0.031118189 -0.916129853 -0.916129827 -0.000000026 -6: 2 0.600 0.030349878 -0.908537498 -0.908537507 0.000000009 -6: 2 0.800 0.029306007 -0.899875935 -0.899875939 0.000000004 -6: 2 1.000 0.028016469 -0.887406482 -0.887406453 -0.000000029 -6: 2 1.200 0.026517171 -0.873372400 -0.873372406 0.000000006 -6: 2 1.400 0.024848378 -0.856614633 -0.856614627 -0.000000006 -6: 2 1.600 0.023052921 -0.837890983 -0.837890975 -0.000000008 -6: 2 1.800 0.021174391 -0.817154056 -0.817154054 -0.000000003 -6: 2 2.000 0.019255418 -0.794632457 -0.794632457 0.000000000 7: dr, rMax = 0.200000 20.000000 7: iSpin r dens Vxc dExc/dDens diff 7: 1 0.000 0.047620227 -0.980238765 @@ -1802,54 +1782,6 @@ 7: 1 1.000 0.042024703 -0.956001234 -0.956001222 -0.000000012 7: 1 1.200 0.039775757 -0.943081485 -0.943081483 -0.000000002 7: 1 1.400 0.037272568 -0.921422546 -0.921422549 0.000000003 -7: 1 1.600 0.034579382 -0.899005838 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-0.119748847 -0.000000094 -7: 1 8.200 0.000010638 -0.100010797 -0.100010654 -0.000000143 -7: 1 8.400 0.000007022 -0.082462504 -0.082462335 -0.000000169 -7: 1 8.600 0.000004589 -0.068350286 -0.068350135 -0.000000151 -7: 1 8.800 0.000002969 -0.057583471 -0.057583442 -0.000000030 -7: 1 9.000 0.000001902 -0.049506694 -0.049507028 0.000000334 -7: 1 9.200 0.000001206 -0.043402831 -0.043404135 0.000001304 -7: 1 9.400 0.000000757 -0.038686660 -0.038688834 0.000002175 -7: 1 9.600 0.000000470 -0.034934582 -0.034936830 0.000002248 -7: 1 9.800 0.000000289 -0.031858263 -0.031860487 0.000002224 -7: 1 10.000 0.000000176 -0.029267821 -0.029269964 0.000002144 -7: 1 10.200 0.000000106 -0.027039672 -0.027041720 0.000002048 -7: 1 10.400 0.000000063 -0.025092806 -0.025094748 0.000001941 -7: 1 10.600 0.000000037 -0.023372816 -0.023374647 0.000001831 -7: 1 10.800 0.000000022 -0.021841709 -0.021843441 0.000001732 -7: 1 11.000 0.000000013 -0.020471625 -0.020473264 0.000001639 8: Ex, Ec: -4.3915197423832746 -0.63516421031255010 8: -1.00270 -1.00104 -0.99606 -0.98881 -0.97797 -0.96486 8: -0.94869 -0.93017 -0.90922 -0.88613 -0.86109 -0.83433 @@ -1920,7 +1852,6 @@ 8: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 8: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 8: 0.00000 0.00000 0.00000 0.00000 -1/9 Test #8: libgridxc_test_match ............. Passed 0.07 sec 1: GGA LYP 0 4 Ex -0.026503515 -0.466631148 0.440127634 2 1: GGA LYP 0 4 Ec -0.009270819 -0.073001911 0.063731093 2 1: GGA WC 0 1 Ex -0.674196998 -0.794408642 0.120211644 2 @@ -2071,6 +2002,47 @@ 1: GGA revPBE 0 2 Ex -0.565307125 -0.645623085 0.080315961 2 1: GGA revPBE 0 3 Ex 0.127015330 0.242628883 0.115613553 2 1: GGA revPBE 0 4 Ex -0.053050185 0.150786655 0.203836840 2 +6: 1 3.200 0.013240188 -0.682792452 -0.682792453 0.000000001 +6: 1 3.400 0.011226266 -0.650510776 -0.650510773 -0.000000003 +7: 1 1.600 0.034579382 -0.899005838 -0.899005838 -0.000000001 +9: Built-in Ex, Ec, sum: -4.35557595 -0.64530376 -5.00087971 +9: -0.96381 -0.96241 -0.95818 -0.95085 -0.94096 -0.92821 +9: -0.91301 -0.89533 -0.87543 -0.85345 -0.82960 -0.80409 +9: -0.77712 -0.74892 -0.71968 -0.68963 -0.65894 -0.62781 +9: -0.59638 -0.56477 -0.53302 -0.50110 -0.46885 -0.43600 +9: -0.40231 -0.36779 -0.33297 -0.29914 -0.26803 -0.24125 +9: -0.21962 -0.20283 -0.18970 -0.17872 -0.16848 -0.15809 +9: -0.14712 -0.13555 -0.12361 -0.11161 -0.09987 -0.08863 +9: -0.07810 -0.06838 -0.05953 -0.05157 -0.04446 -0.03816 +9: -0.03262 -0.02778 -0.02356 -0.01992 -0.01677 -0.01408 +9: -0.01177 -0.00981 -0.00815 -0.00674 -0.00556 -0.00457 +9: -0.00374 -0.00305 -0.00248 -0.00201 -0.00162 -0.00131 +9: -0.00105 -0.00084 -0.00067 -0.00053 -0.00042 -0.00036 +9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 +9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 +9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 +9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 +9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 +9: libxc Ex, Ec, sum: -2.09822342 -2.09822342 -4.19644685 +9: -0.77367 -0.77146 -0.76482 -0.76250 -0.75239 -0.74512 +9: -0.73278 -0.72042 -0.70583 -0.69001 -0.67289 -0.65467 +9: -0.63545 -0.61533 -0.59429 -0.57225 -0.54897 -0.52411 +9: -0.49730 -0.46848 -0.43849 -0.40992 -0.38698 -0.37290 +9: -0.36315 -0.34398 -0.30778 -0.26529 -0.23213 -0.21168 +9: -0.19843 -0.18753 -0.17708 -0.16672 -0.15639 -0.14595 +9: -0.13516 -0.12347 -0.11059 -0.10133 -0.09618 -0.08875 +9: -0.07873 -0.06891 -0.05991 -0.05182 -0.04462 -0.03827 +9: -0.03269 -0.02782 -0.02359 -0.01993 -0.01678 -0.01408 +9: -0.01177 -0.00981 -0.00815 -0.00674 -0.00556 -0.00457 +9: -0.00374 -0.00305 -0.00248 -0.00201 -0.00162 -0.00131 +9: -0.00105 -0.00084 -0.00067 -0.00053 -0.00042 -0.00033 +9: -0.00026 -0.00020 -0.00016 -0.00012 0.00000 0.00000 +9: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 +9: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 +9: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 +9: 0.00000 0.00000 0.00000 0.00000 0.00000 +1/9 Test #8: libgridxc_test_match ............. Passed 0.01 sec +2/9 Test #9: libgridxc_test_hse06 ............. Passed 0.01 sec 1: GGA LYP 0 1 Ex -0.504776390 -0.470442068 0.034334323 2 1: GGA LYP 0 1 Ec -1.279779069 -1.163172591 0.116606478 2 1: GGA LYP 0 2 Ex -0.491743075 -0.526077398 0.034334323 2 @@ -2159,6 +2131,11 @@ 1: GGA LYP 0 4 Ec 0.115299928 0.326349031 0.211049103 2 1: GGA WC 0 1 Ex -0.191741525 -0.967815992 0.776074468 2 1: GGA WC 0 2 Ex -0.247204288 0.528870156 0.776074444 2 +6: 1 3.600 0.009423960 -0.618021733 -0.618021733 0.000000001 +6: 1 3.800 0.007832284 -0.585445444 -0.585445445 0.000000001 +6: 1 4.000 0.006444664 -0.552823710 -0.552823709 -0.000000001 +7: 1 1.800 0.031761587 -0.874045663 -0.874045666 0.000000003 +7: 1 2.000 0.028883127 -0.847548881 -0.847548880 -0.000000001 1: GGA WC 0 3 Ex 0.065856524 0.633676707 0.567820183 2 1: GGA WC 0 4 Ex 0.018267613 -0.850649826 0.868917439 2 1: GGA PBEJsJrLO 0 1 Ex -0.196389007 -0.881120941 0.684731934 2 @@ -2178,8 +2155,10 @@ 1: GGA PBEGcGxHEG 0 3 Ex 0.042799530 0.393346518 0.350546987 2 1: GGA PBEGcGxHEG 0 4 Ex 0.011871948 -0.526240854 0.538112802 2 1: GGA PBESOL 0 1 Ex -0.192725330 -0.851465809 0.658740479 2 +6: 1 4.200 0.005250115 -0.520082870 -0.520082870 0.000000001 1: GGA PBESOL 0 2 Ex -0.245130446 0.413610010 0.658740456 2 1: GGA PBESOL 0 3 Ex 0.062225873 0.549779417 0.487553544 2 +7: 1 2.200 0.026004187 -0.819424112 -0.819424111 -0.000000000 1: GGA PBESOL 0 4 Ex 0.017260524 -0.740408203 0.757668727 2 1: GGA AM05 0 1 Ex -0.148840153 -0.657275207 0.508435053 2 1: GGA AM05 0 1 Ec -0.033428464 -0.019899971 0.013528493 2 @@ -2202,6 +2181,7 @@ 1: GGA C09 0 3 Ex 0.100205973 0.818415586 0.718209613 2 1: GGA C09 0 4 Ex 0.027795635 -1.116682819 1.144478454 2 1: GGA BH 0 1 Ex -0.162550192 -1.317026440 1.154476247 2 +6: 1 4.400 0.004234421 -0.487004137 -0.487004139 0.000000002 1: GGA BH 0 2 Ex -0.225280001 0.929196218 1.154476219 2 1: GGA BH 0 3 Ex 0.074485419 1.084511064 1.010025644 2 1: GGA BH 0 4 Ex 0.020661139 -1.868012431 1.888673570 2 @@ -2215,6 +2195,7 @@ 1: GGA PW91 0 2 Ex -0.596114837 -0.603927490 0.007812653 2 1: GGA PW91 0 3 Ex 0.101898856 0.139724998 0.037826142 2 1: GGA PW91 0 4 Ex 0.041359039 -0.034460967 0.075820006 2 +7: 1 2.400 0.023179251 -0.789580695 -0.789580695 0.000000000 1: GGA PBE 0 1 Ex -0.820946335 -0.811640640 0.009305695 2 1: GGA PBE 0 2 Ex -0.812564005 -0.821869700 0.009305695 2 1: GGA PBE 0 3 Ex 0.004643171 0.054137133 0.049493962 2 @@ -2235,6 +2216,7 @@ 1: GGA LYP 0 3 Ec 0.027027946 0.051805048 0.024777102 2 1: GGA LYP 0 4 Ex 0.026093238 -0.164990361 0.191083599 2 1: GGA LYP 0 4 Ec 0.010970191 -0.035575450 0.046545641 2 +6: 1 4.600 0.003381238 -0.453240679 -0.453240680 0.000000001 1: GGA WC 0 1 Ex -0.847233200 -0.840378707 0.006854493 2 1: GGA WC 0 2 Ex -0.813579879 -0.820434372 0.006854492 2 1: GGA WC 0 3 Ex 0.018641371 0.055164859 0.036523488 2 @@ -2247,7 +2229,9 @@ 1: GGA PBEJsJrHEG 0 2 Ex -0.727587561 -0.733987592 0.006400032 2 1: GGA PBEJsJrHEG 0 3 Ex 0.053660872 0.087700037 0.034039164 2 1: GGA PBEJsJrHEG 0 4 Ex 0.021780049 -0.047851290 0.069631339 2 +7: 1 2.600 0.020455616 -0.758088403 -0.758088406 0.000000003 1: GGA PBEGcGxLO 0 1 Ex -0.822000728 -0.815116888 0.006883840 2 +6: 1 4.800 0.002673091 -0.418441530 -0.418441528 -0.000000002 1: GGA PBEGcGxLO 0 2 Ex -0.801416078 -0.808299917 0.006883839 2 1: GGA PBEGcGxLO 0 3 Ex 0.011402325 0.048145484 0.036743158 2 1: GGA PBEGcGxLO 0 4 Ex 0.004628013 -0.070589374 0.075217387 2 @@ -2269,6 +2253,7 @@ 1: GGA AM05 0 4 Ec -0.010666512 -0.009333963 0.001332549 2 1: GGA PW86 0 1 Ex -0.845514408 -0.834970521 0.010543887 2 1: GGA PW86 0 2 Ex -0.787945884 -0.798489770 0.010543886 2 +6: 1 5.000 0.002092223 -0.382520889 -0.382520888 -0.000000001 1: GGA PW86 0 3 Ex 0.031888569 0.092291723 0.060403154 2 1: GGA PW86 0 4 Ex 0.012943036 -0.112427325 0.125370361 2 1: GGA B88 0 1 Ex -0.783633438 -0.769223615 0.014409823 2 @@ -2276,6 +2261,7 @@ 1: GGA B88 0 3 Ex 0.064186681 0.154736672 0.090549990 2 1: GGA B88 0 4 Ex 0.026052299 -0.164995176 0.191047476 2 1: GGA C09 0 1 Ex -0.841332841 -0.834378491 0.006954351 2 +7: 1 2.800 0.017872394 -0.725194479 -0.725194480 0.000000001 1: GGA C09 0 2 Ex -0.957977822 -0.964932171 0.006954350 2 1: GGA C09 0 3 Ex -0.064612418 -0.027339866 0.037272551 2 1: GGA C09 0 4 Ex -0.026225098 -0.102589972 0.076364874 2 @@ -2295,6 +2281,7 @@ 1: GGA PW91 0 4 Ex -0.273552008 -0.336484310 0.062932302 2 1: GGA PBE 0 1 Ex -0.622324831 -0.689098162 0.066773331 2 1: GGA PBE 0 2 Ex -0.709155656 -0.642382292 0.066773364 2 +6: 1 5.200 0.001621280 -0.346003183 -0.346003181 -0.000000002 1: GGA PBE 0 3 Ex -0.033877975 0.024033291 0.057911266 2 1: GGA PBE 0 4 Ex -0.084417484 -0.141999267 0.057581783 2 1: GGA RPBE 0 1 Ex -0.604261697 -0.702161719 0.097900022 2 @@ -2311,6 +2298,7 @@ 1: GGA LYP 0 2 Ec -0.172763747 -0.033790137 0.138973610 2 1: GGA LYP 0 3 Ex -0.018140654 -0.034051660 0.015911006 2 1: GGA LYP 0 3 Ec 0.090422166 0.304960954 0.214538788 2 +7: 1 3.000 0.015460016 -0.691188323 -0.691188326 0.000000004 1: GGA LYP 0 4 Ex -0.045203066 -0.105129934 0.059926867 2 1: GGA LYP 0 4 Ec 0.225314873 0.067744002 0.157570871 2 1: GGA WC 0 1 Ex -0.603434592 -0.671343346 0.067908754 2 @@ -2318,6 +2306,7 @@ 1: GGA WC 0 3 Ex -0.023831271 0.034982032 0.058813303 2 1: GGA WC 0 4 Ex -0.059383003 -0.117910727 0.058527724 2 1: GGA PBEJsJrLO 0 1 Ex -0.609783107 -0.673020089 0.063236983 2 +6: 1 5.400 0.001243837 -0.310216436 -0.310216435 -0.000000000 1: GGA PBEJsJrLO 0 2 Ex -0.679854633 -0.616617619 0.063237014 2 1: GGA PBEJsJrLO 0 3 Ex -0.027339155 0.027425762 0.054764918 2 1: GGA PBEJsJrLO 0 4 Ex -0.068123985 -0.122624369 0.054500384 2 @@ -2336,7 +2325,9 @@ 1: GGA PBESOL 0 1 Ex -0.605405491 -0.665104568 0.059699077 2 1: GGA PBESOL 0 2 Ex -0.670457583 -0.610758475 0.059699107 2 1: GGA PBESOL 0 3 Ex -0.025380769 0.026256150 0.051636920 2 +6: 1 5.600 0.000944766 -0.277074102 -0.277074102 -0.000000001 1: GGA PBESOL 0 4 Ex -0.063244059 -0.114669608 0.051425548 2 +7: 1 3.200 0.013240188 -0.656330566 -0.656330561 -0.000000005 1: GGA AM05 0 1 Ex -0.532952749 -0.610444210 0.077491461 2 1: GGA AM05 0 1 Ec -0.103322251 -0.102927903 0.000394347 2 1: GGA AM05 0 2 Ex -0.609191692 -0.531700230 0.077491461 2 @@ -2365,6 +2356,7 @@ 1: iSpin dens gradDens 1: 1 0.011823007 0.127642734 0.171177896 -0.100851757 1: 2 0.027207346 0.041356974 0.048934977 -0.051651237 +6: 1 5.800 0.000710460 -0.248426892 -0.248426893 0.000000001 1: 3 -0.014279048 -0.184287664 0.056846076 0.057698292 1: 4 0.010158580 0.043352789 -0.160691567 -0.112515261 1: GGA PW91 0 1 Ex -0.150869746 -0.198919837 0.048050091 2 @@ -2377,6 +2369,7 @@ 1: GGA PBE 0 4 Ex -0.090903157 -0.099810551 0.008907394 2 1: GGA RPBE 0 1 Ex -0.277886236 -0.329504450 0.051618214 2 1: GGA RPBE 0 2 Ex -0.434005865 -0.382387657 0.051618208 2 +7: 1 3.400 0.011226266 -0.620864165 -0.620864164 -0.000000001 1: GGA RPBE 0 3 Ex 0.144903187 0.165420094 0.020516907 2 1: GGA RPBE 0 4 Ex -0.103088848 -0.113335751 0.010246904 2 1: GGA revPBE 0 1 Ex -0.281578849 -0.359719952 0.078141103 2 @@ -2392,6 +2385,7 @@ 1: GGA LYP 0 4 Ex 0.352012663 0.301877907 0.050134756 2 1: GGA LYP 0 4 Ec 0.197665802 0.240725004 0.043059202 2 1: GGA WC 0 1 Ex -0.246894048 -0.304173231 0.057279183 2 +6: 1 6.000 0.000528944 -0.225324029 -0.225324030 0.000000002 1: GGA WC 0 2 Ex -0.361357729 -0.304078550 0.057279178 2 1: GGA WC 0 3 Ex 0.106240018 0.129007014 0.022766997 2 1: GGA WC 0 4 Ex -0.075582609 -0.086953294 0.011370685 2 @@ -2409,8 +2403,10 @@ 1: GGA PBEGcGxLO 0 4 Ex -0.073195729 -0.083397189 0.010201460 2 1: GGA PBEGcGxHEG 0 1 Ex -0.235287479 -0.268147844 0.032860365 2 1: GGA PBEGcGxHEG 0 2 Ex -0.364517345 -0.331656984 0.032860361 2 +7: 1 3.600 0.009423960 -0.585034090 -0.585034093 0.000000003 1: GGA PBEGcGxHEG 0 3 Ex 0.119945324 0.133006470 0.013061146 2 1: GGA PBEGcGxHEG 0 4 Ex -0.085333011 -0.091856231 0.006523220 2 +6: 1 6.200 0.000389881 -0.207630641 -0.207630643 0.000000002 1: GGA PBESOL 0 1 Ex -0.244204747 -0.295594030 0.051389283 2 1: GGA PBESOL 0 2 Ex -0.355053692 -0.303664414 0.051389278 2 1: GGA PBESOL 0 3 Ex 0.102884984 0.123310897 0.020425913 2 @@ -2437,6 +2433,7 @@ 1: GGA C09 0 4 Ex -0.029527821 -0.050154129 0.020626308 2 1: GGA BH 0 1 Ex -0.713872226 -0.784800051 0.070927826 2 1: GGA BH 0 2 Ex -0.557122053 -0.486194230 0.070927822 2 +6: 1 6.400 0.000284517 -0.194187231 -0.194187233 0.000000002 1: GGA BH 0 3 Ex -0.145488430 -0.118047384 0.027441046 2 1: GGA BH 0 4 Ex 0.103505208 0.088369560 0.015135648 2 1: @@ -2448,6 +2445,7 @@ 1: GGA PW91 0 1 Ex -0.917493591 -0.932965023 0.015471432 2 1: GGA PW91 0 2 Ex -0.724878344 -0.709406901 0.015471443 2 1: GGA PW91 0 3 Ex 0.317906206 0.321279947 0.003373741 2 +7: 1 3.800 0.007832284 -0.549094197 -0.549094197 -0.000000000 1: GGA PW91 0 4 Ex -0.072608953 -0.037316443 0.035292510 2 1: GGA PBE 0 1 Ex -1.136487662 -1.142803560 0.006315898 2 1: GGA PBE 0 2 Ex -1.115006670 -1.108690758 0.006315911 2 @@ -2463,6 +2461,7 @@ 1: GGA revPBE 0 4 Ex 0.018247491 0.047408254 0.029160763 2 1: GGA LYP 0 1 Ex -1.076230881 -1.033672213 0.042558668 2 1: GGA LYP 0 1 Ec -0.486258691 -0.535620198 0.049361507 2 +6: 1 6.600 0.000205559 -0.183339501 -0.183339503 0.000000001 1: GGA LYP 0 2 Ex -1.007380419 -1.049939087 0.042558668 2 1: GGA LYP 0 2 Ec -0.673195587 -0.623834080 0.049361507 2 1: GGA LYP 0 3 Ex 0.113635807 0.135987656 0.022351849 2 @@ -2481,11 +2480,13 @@ 1: GGA PBEJsJrHEG 0 2 Ex -1.020260050 -1.015904759 0.004355291 2 1: GGA PBEJsJrHEG 0 3 Ex 0.106154650 0.109392994 0.003238344 2 1: GGA PBEJsJrHEG 0 4 Ex -0.024245447 -0.004290091 0.019955356 2 +7: 1 4.000 0.006444664 -0.513309680 -0.513309680 -0.000000000 1: GGA PBEGcGxLO 0 1 Ex -1.133933017 -1.137210250 0.003277233 2 1: GGA PBEGcGxLO 0 2 Ex -1.107918271 -1.104641026 0.003277246 2 1: GGA PBEGcGxLO 0 3 Ex 0.042936628 0.045697911 0.002761284 2 1: GGA PBEGcGxLO 0 4 Ex -0.009806614 0.006630102 0.016436716 2 1: GGA PBEGcGxHEG 0 1 Ex -1.084244549 -1.087738333 0.003493784 2 +6: 1 6.800 0.000147033 -0.173510692 -0.173510693 0.000000002 1: GGA PBEGcGxHEG 0 2 Ex -1.018938281 -1.015444485 0.003493797 2 1: GGA PBEGcGxHEG 0 3 Ex 0.107786211 0.110459161 0.002672950 2 1: GGA PBEGcGxHEG 0 4 Ex -0.024618091 -0.008280896 0.016337195 2 @@ -2509,6 +2510,7 @@ 1: GGA B88 0 2 Ex -1.006869403 -1.049424996 0.042555593 2 1: GGA B88 0 3 Ex 0.113393475 0.135740598 0.022347123 2 1: GGA B88 0 4 Ex -0.025898776 0.015499131 0.041397907 2 +6: 1 7.000 0.000104122 -0.163573430 -0.163573432 0.000000002 1: GGA C09 0 1 Ex -1.239750789 -1.242397181 0.002646392 2 1: GGA C09 0 2 Ex -1.296544516 -1.293898110 0.002646406 2 1: GGA C09 0 3 Ex -0.093736495 -0.091734771 0.002001724 2 @@ -2516,6 +2518,7 @@ 1: GGA BH 0 1 Ex -1.145636323 -1.134195762 0.011440561 2 1: GGA BH 0 2 Ex -1.128124601 -1.139565147 0.011440547 2 1: GGA BH 0 3 Ex 0.028902619 0.035712269 0.006809650 2 +7: 1 4.200 0.005250115 -0.477958213 -0.477958214 0.000000001 1: GGA BH 0 4 Ex -0.006601283 0.008039021 0.014640304 2 1: 1: iSpin dens gradDens @@ -2535,6 +2538,7 @@ 1: GGA RPBE 0 2 Ex -1.346811053 -1.318858421 0.027952633 2 1: GGA RPBE 0 3 Ex 0.086687046 0.101185503 0.014498458 2 1: GGA RPBE 0 4 Ex 0.066465919 0.072293240 0.005827320 2 +6: 1 7.200 0.000072999 -0.152957536 -0.152957539 0.000000003 1: GGA revPBE 0 1 Ex -1.411110095 -1.438550036 0.027439941 2 1: GGA revPBE 0 2 Ex -1.412081720 -1.384641784 0.027439936 2 1: GGA revPBE 0 3 Ex 0.000715987 0.014365878 0.013649891 2 @@ -2553,12 +2557,14 @@ 1: GGA WC 0 4 Ex 0.074402408 0.079940806 0.005538399 2 1: GGA PBEJsJrLO 0 1 Ex -1.215547434 -1.234427905 0.018880470 2 1: GGA PBEJsJrLO 0 2 Ex -1.350009729 -1.331129264 0.018880465 2 +7: 1 4.400 0.004234421 -0.443329016 -0.443329013 -0.000000003 1: GGA PBEJsJrLO 0 3 Ex 0.099084723 0.108524466 0.009439743 2 1: GGA PBEJsJrLO 0 4 Ex 0.075971642 0.080368284 0.004396642 2 1: GGA PBEJsJrHEG 0 1 Ex -1.104815112 -1.123370514 0.018555402 2 1: GGA PBEJsJrHEG 0 2 Ex -1.311046508 -1.292491112 0.018555397 2 1: GGA PBEJsJrHEG 0 3 Ex 0.151971085 0.161427350 0.009456265 2 1: GGA PBEJsJrHEG 0 4 Ex 0.116521423 0.120608849 0.004087426 2 +6: 1 7.400 0.000050669 -0.141563831 -0.141563836 0.000000005 1: GGA PBEGcGxLO 0 1 Ex -1.213035425 -1.228514168 0.015478744 2 1: GGA PBEGcGxLO 0 2 Ex -1.352032263 -1.336553524 0.015478739 2 1: GGA PBEGcGxLO 0 3 Ex 0.102426210 0.110024699 0.007598489 2 @@ -2583,9 +2589,11 @@ 1: GGA PW86 0 2 Ex -1.337820717 -1.313254132 0.024566586 2 1: GGA PW86 0 3 Ex 0.075466873 0.071607486 0.003859387 2 1: GGA PW86 0 4 Ex 0.057863030 0.084636772 0.026773742 2 +6: 1 7.600 0.000034818 -0.129595146 -0.129595152 0.000000006 1: GGA B88 0 1 Ex -1.103069339 -1.108459764 0.005390425 2 1: GGA B88 0 2 Ex -1.302431963 -1.297041544 0.005390419 2 1: GGA B88 0 3 Ex 0.146909514 0.091939416 0.054970098 2 +7: 1 4.600 0.003381238 -0.409718658 -0.409718659 0.000000001 1: GGA B88 0 4 Ex 0.112640543 0.189104600 0.076464057 2 1: GGA C09 0 1 Ex -1.442453933 -1.454415454 0.011961521 2 1: GGA C09 0 2 Ex -1.436978779 -1.425017263 0.011961516 2 @@ -2610,6 +2618,7 @@ 1: GGA PBE 0 3 Ex 0.000261568 -0.088665754 0.088927322 2 1: GGA PBE 0 4 Ex 0.015176425 -0.278682589 0.293859014 2 1: GGA RPBE 0 1 Ex -1.067811961 -0.859640017 0.208171944 2 +6: 1 7.800 0.000023687 -0.117391049 -0.117391056 0.000000007 1: GGA RPBE 0 2 Ex -1.350626107 -1.558798096 0.208171988 2 1: GGA RPBE 0 3 Ex 0.001454815 -0.051138818 0.052593634 2 1: GGA RPBE 0 4 Ex 0.084409670 -0.263423342 0.347833012 2 @@ -2625,6 +2634,7 @@ 1: GGA LYP 0 3 Ec 0.000533021 0.123161099 0.122628078 2 1: GGA LYP 0 4 Ex -0.073811042 -0.488260562 0.414449519 2 1: GGA LYP 0 4 Ec 0.030926368 0.003585859 0.027340509 2 +7: 1 4.800 0.002673091 -0.377422521 -0.377422522 0.000000001 1: GGA WC 0 1 Ex -1.162114398 -1.018001799 0.144112599 2 1: GGA WC 0 2 Ex -1.087538193 -1.231650833 0.144112640 2 1: GGA WC 0 3 Ex -0.000383625 -0.131360471 0.130976846 2 @@ -2634,6 +2644,7 @@ 1: GGA PBEJsJrLO 0 3 Ex -0.000221791 -0.117983788 0.117761997 2 1: GGA PBEJsJrLO 0 4 Ex -0.012868510 -0.271237182 0.258368672 2 1: GGA PBEJsJrHEG 0 1 Ex -1.148303939 -1.027092833 0.121211106 2 +6: 1 8.000 0.000015954 -0.105308033 -0.105308040 0.000000007 1: GGA PBEJsJrHEG 0 2 Ex -1.093037804 -1.214248949 0.121211145 2 1: GGA PBEJsJrHEG 0 3 Ex -0.000284293 -0.061107144 0.060822851 2 1: GGA PBEJsJrHEG 0 4 Ex -0.016494918 -0.218505189 0.202010271 2 @@ -2657,6 +2668,8 @@ 1: GGA AM05 0 3 Ec 0.000138526 0.000022761 0.000115765 2 1: GGA AM05 0 4 Ex -0.102744084 -0.319109001 0.216364917 2 1: GGA AM05 0 4 Ec 0.008037378 0.012139561 0.004102182 2 +6: 1 8.200 0.000010638 -0.093651613 -0.093651624 0.000000011 +7: 1 5.000 0.002092223 -0.346721404 -0.346721404 0.000000000 1: GGA PW86 0 1 Ex -1.144133499 -0.945902836 0.198230663 2 1: GGA PW86 0 2 Ex -1.076112754 -1.274343462 0.198230708 2 1: GGA PW86 0 3 Ex -0.000349903 -0.159609616 0.159259712 2 @@ -2683,6 +2696,7 @@ 1: GGA PW91 0 2 Ex -0.931507400 -1.148656005 0.217148605 2 1: GGA PW91 0 3 Ex 0.064280832 -0.028020547 0.092301379 2 1: GGA PW91 0 4 Ex -0.017178700 0.256130875 0.273309574 2 +6: 1 8.400 0.000007022 -0.082649174 -0.082649186 0.000000012 1: GGA PBE 0 1 Ex -0.798153354 -0.570819284 0.227334070 2 1: GGA PBE 0 2 Ex -0.823875615 -1.051209690 0.227334074 2 1: GGA PBE 0 3 Ex 0.016890923 -0.084001793 0.100892716 2 @@ -2693,6 +2707,7 @@ 1: GGA RPBE 0 4 Ex -0.027053581 0.330330711 0.357384292 2 1: GGA revPBE 0 1 Ex -0.767943056 -0.491697294 0.276245762 2 1: GGA revPBE 0 2 Ex -0.814591423 -1.090837190 0.276245767 2 +7: 1 5.200 0.001621280 -0.317864014 -0.317864014 -0.000000000 1: GGA revPBE 0 3 Ex 0.030632375 -0.095874935 0.126507311 2 1: GGA revPBE 0 4 Ex -0.008186334 0.305505684 0.313692018 2 1: GGA LYP 0 1 Ex -0.744722152 -0.504836772 0.239885379 2 @@ -2707,6 +2722,7 @@ 1: GGA WC 0 2 Ex -0.795178791 -0.958737024 0.163558234 2 1: GGA WC 0 3 Ex -0.015882968 -0.091141628 0.075258659 2 1: GGA WC 0 4 Ex 0.004244636 0.188638631 0.184393995 2 +6: 1 8.600 0.000004589 -0.072448262 -0.072448275 0.000000013 1: GGA PBEJsJrLO 0 1 Ex -0.788502591 -0.602831547 0.185671044 2 1: GGA PBEJsJrLO 0 2 Ex -0.770841486 -0.956512535 0.185671049 2 1: GGA PBEJsJrLO 0 3 Ex -0.011597440 -0.096159057 0.084561618 2 @@ -2726,7 +2742,9 @@ 1: GGA PBESOL 0 1 Ex -0.785803102 -0.622496001 0.163307101 2 1: GGA PBESOL 0 2 Ex -0.742105206 -0.905412311 0.163307105 2 1: GGA PBESOL 0 3 Ex -0.028694903 -0.104432293 0.075737391 2 +7: 1 5.400 0.001243837 -0.291048148 -0.291048147 -0.000000002 1: GGA PBESOL 0 4 Ex 0.007668555 0.189555681 0.181887126 2 +6: 1 8.800 0.000002969 -0.063127570 -0.063127580 0.000000010 1: GGA AM05 0 1 Ex -0.741523707 -0.636663916 0.104859791 2 1: GGA AM05 0 1 Ec -0.058933146 -0.063367549 0.004434403 2 1: GGA AM05 0 2 Ex -0.562126061 -0.666985852 0.104859791 2 @@ -2735,119 +2753,6 @@ 1: GGA AM05 0 3 Ec 0.012857405 0.014743147 0.001885741 2 1: GGA AM05 0 4 Ex 0.031482540 0.113854917 0.082372377 2 1: GGA AM05 0 4 Ec -0.003436071 -0.009014159 0.005578088 2 -6: 2 2.200 0.017336125 -0.770502247 -0.770502247 0.000000000 -6: 2 2.400 0.015452834 -0.744951774 -0.744951773 -0.000000000 -6: 2 2.600 0.013637077 -0.718168689 -0.718168693 0.000000004 -6: 2 2.800 0.011914930 -0.690336837 -0.690336838 0.000000001 -6: 2 3.000 0.010306678 -0.661632866 -0.661632868 0.000000001 -6: 2 3.200 0.008826792 -0.632223061 -0.632223055 -0.000000006 -6: 2 3.400 0.007484177 -0.602259891 -0.602259889 -0.000000002 -6: 2 3.600 0.006282640 -0.571876952 -0.571876952 0.000000000 -6: 2 3.800 0.005221523 -0.541180002 -0.541180003 0.000000001 -6: 2 4.000 0.004296443 -0.510231603 -0.510231603 -0.000000000 -6: 2 4.200 0.003500077 -0.479029886 -0.479029885 -0.000000000 -6: 2 4.400 0.002822947 -0.447492103 -0.447492104 0.000000001 -6: 2 4.600 0.002254159 -0.415472518 -0.415472517 -0.000000001 -6: 2 4.800 0.001782061 -0.382860808 -0.382860808 -0.000000000 -6: 2 5.000 0.001394815 -0.349787495 -0.349787494 -0.000000001 -6: 2 5.200 0.001080853 -0.316870200 -0.316870200 -0.000000000 -6: 2 5.400 0.000829225 -0.285306984 -0.285306984 -0.000000000 -6: 2 5.600 0.000629844 -0.256619554 -0.256619554 -0.000000000 -6: 2 5.800 0.000473640 -0.232083909 -0.232083909 -0.000000000 -6: 2 6.000 0.000352629 -0.212182116 -0.212182116 -0.000000000 -6: 2 6.200 0.000259921 -0.196433380 -0.196433380 -0.000000000 -6: 2 6.400 0.000189678 -0.183672030 -0.183672030 0.000000000 -6: 2 6.600 0.000137039 -0.172541723 -0.172541726 0.000000003 -6: 2 6.800 0.000098022 -0.161917868 -0.161917872 0.000000004 -6: 2 7.000 0.000069415 -0.151110560 -0.151110563 0.000000003 -6: 2 7.200 0.000048666 -0.139861549 -0.139861554 0.000000005 -6: 2 7.400 0.000033779 -0.128226737 -0.128226743 0.000000006 -6: 2 7.600 0.000023212 -0.116433222 -0.116433229 0.000000007 -6: 2 7.800 0.000015792 -0.104762753 -0.104762762 0.000000009 -6: 2 8.000 0.000010636 -0.093477793 -0.093477805 0.000000011 -6: 2 8.200 0.000007092 -0.082785576 -0.082785590 0.000000014 -6: 2 8.400 0.000004681 -0.072828254 -0.072828270 0.000000016 -6: 2 8.600 0.000003059 -0.063687629 -0.063687643 0.000000014 -6: 2 8.800 0.000001979 -0.055396187 -0.055396188 0.000000001 -6: 2 9.000 0.000001268 -0.047949450 -0.047949418 -0.000000032 -6: 2 9.200 0.000000804 -0.041317198 -0.041317116 -0.000000081 -6: 2 9.400 0.000000504 -0.035452601 -0.035452510 -0.000000091 -6: 2 9.600 0.000000313 -0.030299188 -0.030299098 -0.000000090 -6: 2 9.800 0.000000193 -0.025795893 -0.025795813 -0.000000081 -6: 2 10.000 0.000000117 -0.021880577 -0.021880500 -0.000000077 -6: 2 10.200 0.000000071 -0.018492378 -0.018492315 -0.000000063 -6: 2 10.400 0.000000042 -0.015573224 -0.015573163 -0.000000061 -6: 2 10.600 0.000000025 -0.013068736 -0.013068683 -0.000000052 -6: 2 10.800 0.000000015 -0.010928714 -0.010928690 -0.000000024 -6: 2 11.000 0.000000008 -0.009107337 -0.009107277 -0.000000060 -6: 2 11.200 0.000000005 -0.007563161 -0.007563174 0.000000013 -6: 2 11.400 0.000000003 -0.006258998 -0.006258965 -0.000000033 -6: 2 11.600 0.000000002 -0.005161710 -0.005161583 -0.000000127 -6: avgDiffVxc, maxDiffVxc = 0.000000036 0.000000274 -7: 1 11.200 0.000000007 -0.019241059 -0.019242615 0.000001555 -7: 1 11.400 0.000000004 -0.018132612 -0.018133968 0.000001356 -7: 1 11.600 0.000000002 -0.017131679 -0.017133117 0.000001438 -7: 1 11.800 0.000000001 -0.016225680 -0.016226768 0.000001088 -7: iSpin r dens Vxc dExc/dDens diff -7: 2 0.000 0.031746818 -0.900701729 -7: 2 0.200 0.031588480 -0.903820205 -0.903820038 -0.000000167 -7: 2 0.400 0.031118189 -0.913175632 -0.913175702 0.000000070 -7: 2 0.600 0.030349878 -0.898888840 -0.898888767 -0.000000073 -7: 2 0.800 0.029306007 -0.900387339 -0.900387287 -0.000000052 -7: 2 1.000 0.028016469 -0.881655824 -0.881655827 0.000000003 -7: 2 1.200 0.026517171 -0.869787130 -0.869787142 0.000000012 -7: 2 1.400 0.024848378 -0.849409711 -0.849409707 -0.000000004 -7: 2 1.600 0.023052921 -0.829194760 -0.829194762 0.000000002 -7: 2 1.800 0.021174391 -0.806916840 -0.806916844 0.000000004 -7: 2 2.000 0.019255418 -0.783153757 -0.783153761 0.000000004 -7: 2 2.200 0.017336125 -0.757597743 -0.757597741 -0.000000002 -7: 2 2.400 0.015452834 -0.730277351 -0.730277348 -0.000000003 -7: 2 2.600 0.013637077 -0.701421448 -0.701421449 0.000000001 -7: 2 2.800 0.011914930 -0.671294327 -0.671294326 -0.000000001 -7: 2 3.000 0.010306678 -0.640127830 -0.640127826 -0.000000003 -7: 2 3.200 0.008826792 -0.608140908 -0.608140904 -0.000000003 -7: 2 3.400 0.007484177 -0.575559240 -0.575559246 0.000000006 -7: 2 3.600 0.006282640 -0.542620903 -0.542620905 0.000000002 -7: 2 3.800 0.005221523 -0.509578436 -0.509578436 -0.000000000 -7: 2 4.000 0.004296443 -0.476699712 -0.476699710 -0.000000003 -7: 2 4.200 0.003500077 -0.444266875 -0.444266874 -0.000000001 -9: Built-in Ex, Ec, sum: -4.35557595 -0.64530376 -5.00087971 -9: -0.96381 -0.96241 -0.95818 -0.95085 -0.94096 -0.92821 -9: -0.91301 -0.89533 -0.87543 -0.85345 -0.82960 -0.80409 -9: -0.77712 -0.74892 -0.71968 -0.68963 -0.65894 -0.62781 -9: -0.59638 -0.56477 -0.53302 -0.50110 -0.46885 -0.43600 -9: -0.40231 -0.36779 -0.33297 -0.29914 -0.26803 -0.24125 -9: -0.21962 -0.20283 -0.18970 -0.17872 -0.16848 -0.15809 -9: -0.14712 -0.13555 -0.12361 -0.11161 -0.09987 -0.08863 -9: -0.07810 -0.06838 -0.05953 -0.05157 -0.04446 -0.03816 -9: -0.03262 -0.02778 -0.02356 -0.01992 -0.01677 -0.01408 -9: -0.01177 -0.00981 -0.00815 -0.00674 -0.00556 -0.00457 -9: -0.00374 -0.00305 -0.00248 -0.00201 -0.00162 -0.00131 -9: -0.00105 -0.00084 -0.00067 -0.00053 -0.00042 -0.00036 -9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -9: libxc Ex, Ec, sum: -2.09822342 -2.09822342 -4.19644685 -9: -0.77367 -0.77146 -0.76482 -0.76250 -0.75239 -0.74512 -9: -0.73278 -0.72042 -0.70583 -0.69001 -0.67289 -0.65467 -9: -0.63545 -0.61533 -0.59429 -0.57225 -0.54897 -0.52411 -9: -0.49730 -0.46848 -0.43849 -0.40992 -0.38698 -0.37290 -9: -0.36315 -0.34398 -0.30778 -0.26529 -0.23213 -0.21168 -9: -0.19843 -0.18753 -0.17708 -0.16672 -0.15639 -0.14595 -9: -0.13516 -0.12347 -0.11059 -0.10133 -0.09618 -0.08875 -9: -0.07873 -0.06891 -0.05991 -0.05182 -0.04462 -0.03827 -9: -0.03269 -0.02782 -0.02359 -0.01993 -0.01678 -0.01408 -9: -0.01177 -0.00981 -0.00815 -0.00674 -0.00556 -0.00457 -9: -0.00374 -0.00305 -0.00248 -0.00201 -0.00162 -0.00131 -9: -0.00105 -0.00084 -0.00067 -0.00053 -0.00042 -0.00033 -9: -0.00026 -0.00020 -0.00016 -0.00012 0.00000 0.00000 -9: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -9: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -9: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -9: 0.00000 0.00000 0.00000 0.00000 0.00000 -2/9 Test #9: libgridxc_test_hse06 ............. 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-0.003943518 0.209895288 0.213838806 2 1: GGA LYP 0 4 Ex -0.035451179 -0.078167171 0.042715992 2 @@ -3446,6 +3393,7 @@ 1: GGA PBEJsJrLO 0 4 Ex 0.039401923 0.011331205 0.028070718 2 1: GGA PBEJsJrHEG 0 1 Ex -0.629153243 -0.569556341 0.059596901 2 1: GGA PBEJsJrHEG 0 2 Ex -0.633111321 -0.692708233 0.059596912 2 +7: 1 8.800 0.000002969 -0.057583471 -0.057583442 -0.000000030 1: GGA PBEJsJrHEG 0 3 Ex -0.002191838 0.093652705 0.095844543 2 1: GGA PBEJsJrHEG 0 4 Ex -0.004571423 -0.024725129 0.020153705 2 1: GGA PBEGcGxLO 0 1 Ex -0.647994359 -0.571931357 0.076063002 2 @@ -3453,6 +3401,7 @@ 1: GGA PBEGcGxLO 0 3 Ex 0.018087269 0.142347133 0.124259863 2 1: GGA PBEGcGxLO 0 4 Ex 0.037723844 0.011074410 0.026649434 2 1: GGA PBEGcGxHEG 0 1 Ex -0.618891835 -0.560771052 0.058120784 2 +6: 2 2.000 0.019255418 -0.794632457 -0.794632457 0.000000000 1: GGA PBEGcGxHEG 0 2 Ex -0.620355704 -0.678476498 0.058120794 2 1: GGA PBEGcGxHEG 0 3 Ex -0.000810637 0.093044810 0.093855446 2 1: GGA PBEGcGxHEG 0 4 Ex -0.001690710 -0.021529746 0.019839036 2 @@ -3476,10 +3425,12 @@ 1: GGA B88 0 2 Ex -0.537455658 -0.591909565 0.054453907 2 1: GGA B88 0 3 Ex -0.016982044 0.121264093 0.138246136 2 1: GGA B88 0 4 Ex -0.035418722 -0.078129002 0.042710280 2 +6: 2 2.200 0.017336125 -0.770502247 -0.770502247 0.000000000 1: GGA C09 0 1 Ex -0.769564736 -0.662908984 0.106655753 2 1: GGA C09 0 2 Ex -0.629518847 -0.736174613 0.106655766 2 1: GGA C09 0 3 Ex 0.077552260 0.248129948 0.170577688 2 1: GGA C09 0 4 Ex 0.161747433 0.126134287 0.035613146 2 +7: 1 9.000 0.000001902 -0.049506694 -0.049507028 0.000000334 1: GGA BH 0 1 Ex -0.570628414 -0.451586545 0.119041869 2 1: GGA BH 0 2 Ex -0.500417443 -0.619459325 0.119041882 2 1: GGA BH 0 3 Ex 0.038880252 0.245848124 0.206967872 2 @@ -3505,6 +3456,7 @@ 1: GGA revPBE 0 1 Ex -0.268224869 -0.243313783 0.024911087 2 1: GGA revPBE 0 2 Ex -0.236227634 -0.261138689 0.024911055 2 1: GGA revPBE 0 3 Ex 0.017108880 0.000376596 0.016732284 2 +6: 2 2.400 0.015452834 -0.744951774 -0.744951773 -0.000000000 1: GGA revPBE 0 4 Ex 0.142795181 0.147590950 0.004795769 2 1: GGA LYP 0 1 Ex -1.262737235 -1.170755375 0.091981860 2 1: GGA LYP 0 1 Ec -0.210814784 -0.138985181 0.071829603 2 @@ -3520,6 +3472,7 @@ 1: GGA WC 0 4 Ex 0.141314921 0.144086148 0.002771228 2 1: GGA PBEJsJrLO 0 1 Ex -0.237069065 -0.221508576 0.015560489 2 1: GGA PBEJsJrLO 0 2 Ex -0.207069775 -0.222630238 0.015560462 2 +7: 1 9.200 0.000001206 -0.043402831 -0.043404135 0.000001304 1: GGA PBEJsJrLO 0 3 Ex 0.016040581 0.005588900 0.010451681 2 1: GGA PBEJsJrLO 0 4 Ex 0.133878879 0.136874513 0.002995634 2 1: GGA PBEJsJrHEG 0 1 Ex -0.227758077 -0.219185420 0.008572657 2 @@ -3529,6 +3482,7 @@ 1: GGA PBEGcGxLO 0 1 Ex -0.227790156 -0.210621711 0.017168445 2 1: GGA PBEGcGxLO 0 2 Ex -0.199638378 -0.216806797 0.017168419 2 1: GGA PBEGcGxLO 0 3 Ex 0.015052719 0.003521009 0.011531710 2 +6: 2 2.600 0.013637077 -0.718168689 -0.718168693 0.000000004 1: GGA PBEGcGxLO 0 4 Ex 0.125633924 0.128939115 0.003305191 2 1: GGA PBEGcGxHEG 0 1 Ex -0.221888616 -0.212175065 0.009713551 2 1: GGA PBEGcGxHEG 0 2 Ex -0.192508774 -0.202222301 0.009713527 2 @@ -3554,6 +3508,8 @@ 1: GGA B88 0 2 Ex -1.512390643 -1.604370915 0.091980272 2 1: GGA B88 0 3 Ex -0.133496135 -0.140162390 0.006666255 2 1: GGA B88 0 4 Ex -1.114193586 -1.103089498 0.011104087 2 +7: 1 9.400 0.000000757 -0.038686660 -0.038688834 0.000002175 +6: 2 2.800 0.011914930 -0.690336837 -0.690336838 0.000000001 1: GGA C09 0 1 Ex -0.203331792 -0.158396493 0.044935300 2 1: GGA C09 0 2 Ex -0.184255353 -0.229190622 0.044935269 2 1: GGA C09 0 3 Ex 0.010200148 -0.019981968 0.030182115 2 @@ -3580,6 +3536,7 @@ 1: GGA RPBE 0 2 Ex -1.084070239 -1.041900629 0.042169610 2 1: GGA RPBE 0 3 Ex 0.010016347 -0.073170482 0.083186830 2 1: GGA RPBE 0 4 Ex 0.061535632 0.086410804 0.024875172 2 +6: 2 3.000 0.010306678 -0.661632866 -0.661632868 0.000000001 1: GGA revPBE 0 1 Ex -1.198771464 -1.239364016 0.040592552 2 1: GGA revPBE 0 2 Ex -1.174805944 -1.134213388 0.040592555 2 1: GGA revPBE 0 3 Ex -0.007256610 -0.087624806 0.080368196 2 @@ -3593,6 +3550,7 @@ 1: GGA LYP 0 4 Ex 0.076437339 0.118431354 0.041994015 2 1: GGA LYP 0 4 Ec -0.150831785 -0.151532953 0.000701168 2 1: GGA WC 0 1 Ex -1.072346026 -1.099013303 0.026667277 2 +7: 1 9.600 0.000000470 -0.034934582 -0.034936830 0.000002248 1: GGA WC 0 2 Ex -1.126786913 -1.100119633 0.026667280 2 1: GGA WC 0 3 Ex 0.016484360 -0.036308491 0.052792851 2 1: GGA WC 0 4 Ex 0.101271999 0.117033047 0.015761048 2 @@ -3604,6 +3562,7 @@ 1: GGA PBEJsJrHEG 0 2 Ex -1.069380369 -1.044293587 0.025086782 2 1: GGA PBEJsJrHEG 0 3 Ex 0.026038384 -0.023533397 0.049571782 2 1: GGA PBEJsJrHEG 0 4 Ex 0.159967339 0.174779267 0.014811928 2 +6: 2 3.200 0.008826792 -0.632223061 -0.632223055 -0.000000006 1: GGA PBEGcGxLO 0 1 Ex -1.066658168 -1.090099051 0.023440882 2 1: GGA PBEGcGxLO 0 2 Ex -1.118052047 -1.094611163 0.023440885 2 1: GGA PBEGcGxLO 0 3 Ex 0.015561745 -0.030895771 0.046457516 2 @@ -3625,6 +3584,8 @@ 1: GGA AM05 0 4 Ex 0.179506720 0.198874084 0.019367364 2 1: GGA AM05 0 4 Ec -0.049909738 -0.050414177 0.000504439 2 1: GGA PW86 0 1 Ex -1.153882449 -1.201098507 0.047216057 2 +6: 2 3.400 0.007484177 -0.602259891 -0.602259889 -0.000000002 +7: 1 9.800 0.000000289 -0.031858263 -0.031860487 0.000002224 1: GGA PW86 0 2 Ex -1.145843034 -1.098626973 0.047216060 2 1: GGA PW86 0 3 Ex -0.002434285 -0.117775649 0.115341364 2 1: GGA PW86 0 4 Ex -0.014955078 0.016510404 0.031465481 2 @@ -3652,6 +3613,7 @@ 1: GGA PW91 0 4 Ex -0.281825906 -0.159169778 0.122656128 2 1: GGA PBE 0 1 Ex -1.218515853 -1.380791947 0.162276094 2 1: GGA PBE 0 2 Ex -1.068651132 -0.906375056 0.162276076 2 +6: 2 3.600 0.006282640 -0.571876952 -0.571876952 0.000000000 1: GGA PBE 0 3 Ex 0.029196787 0.210566890 0.181370103 2 1: GGA PBE 0 4 Ex -0.086519268 0.115229486 0.201748754 2 1: GGA RPBE 0 1 Ex -1.397627318 -1.566263964 0.168636646 2 @@ -3664,41 +3626,8 @@ 1: GGA revPBE 0 4 Ex -0.127331614 0.111163249 0.238494863 2 1: GGA LYP 0 1 Ex -0.863844163 -1.119812533 0.255968370 2 1: GGA LYP 0 1 Ec -0.253251010 -0.231216198 0.022034813 2 +7: 1 10.000 0.000000176 -0.029267821 -0.029269964 0.000002144 1: GGA LYP 0 2 Ex -0.996344646 -0.740376275 0.255968370 2 -7: 2 4.400 0.002822947 -0.412572354 -0.412572354 -0.000000000 -7: 2 4.600 0.002254159 -0.381911080 -0.381911079 -0.000000000 -7: 2 4.800 0.001782061 -0.352568553 -0.352568554 0.000000001 -7: 2 5.000 0.001394815 -0.324805491 -0.324805493 0.000000001 -7: 2 5.200 0.001080853 -0.298841517 -0.298841517 -0.000000000 -7: 2 5.400 0.000829225 -0.274842954 -0.274842954 0.000000000 -7: 2 5.600 0.000629844 -0.252923338 -0.252923338 0.000000000 -7: 2 5.800 0.000473640 -0.233169001 -0.233169001 -0.000000001 -7: 2 6.000 0.000352629 -0.215702309 -0.215702310 0.000000001 -7: 2 6.200 0.000259921 -0.200780146 -0.200780146 0.000000000 -7: 2 6.400 0.000189678 -0.188871729 -0.188871731 0.000000002 -7: 2 6.600 0.000137039 -0.180551188 -0.180551190 0.000000003 -7: 2 6.800 0.000098022 -0.175955357 -0.175955367 0.000000010 -7: 2 7.000 0.000069415 -0.173810452 -0.173810467 0.000000016 -7: 2 7.200 0.000048666 -0.170894083 -0.170894097 0.000000014 -7: 2 7.400 0.000033779 -0.163293898 -0.163293895 -0.000000004 -7: 2 7.600 0.000023212 -0.149116243 -0.149116198 -0.000000045 -7: 2 7.800 0.000015792 -0.129929391 -0.129929289 -0.000000102 -7: 2 8.000 0.000010636 -0.109368250 -0.109368094 -0.000000157 -7: 2 8.200 0.000007092 -0.090658025 -0.090657833 -0.000000193 -7: 2 8.400 0.000004681 -0.075347142 -0.075346959 -0.000000183 -7: 2 8.600 0.000003059 -0.063522910 -0.063522832 -0.000000078 -7: 2 8.800 0.000001979 -0.054565736 -0.054565986 0.000000250 -7: 2 9.000 0.000001268 -0.047730494 -0.047731613 0.000001119 -7: 2 9.200 0.000000804 -0.042399692 -0.042401841 0.000002149 -7: 2 9.400 0.000000504 -0.038127408 -0.038129670 0.000002261 -7: 2 9.600 0.000000313 -0.034608838 -0.034611088 0.000002249 -7: 2 9.800 0.000000193 -0.031640567 -0.031642752 0.000002185 -7: 2 10.000 0.000000117 -0.029088011 -0.029090106 0.000002095 -7: 2 10.200 0.000000071 -0.026861487 -0.026863473 0.000001986 -7: 2 10.400 0.000000042 -0.024899792 -0.024901681 0.000001888 -7: 2 10.600 0.000000025 -0.023159554 -0.023161337 0.000001783 -7: 2 10.800 0.000000015 -0.021608555 -0.021610223 0.000001668 -3/9 Test #6: libgridxc_test_libxc ............. Passed 0.16 sec 1: GGA LYP 0 2 Ec -0.113415508 -0.135450320 0.022034813 2 1: GGA LYP 0 3 Ex -0.025813870 0.219727558 0.245541428 2 1: GGA LYP 0 3 Ec 0.027242885 0.027406344 0.000163458 2 @@ -3710,6 +3639,7 @@ 1: GGA WC 0 4 Ex -0.066993361 0.088953594 0.155946955 2 1: GGA PBEJsJrLO 0 1 Ex -1.159767487 -1.289668575 0.129901088 2 1: GGA PBEJsJrLO 0 2 Ex -1.069583293 -0.939682222 0.129901071 2 +6: 2 3.800 0.005221523 -0.541180002 -0.541180003 0.000000001 1: GGA PBEJsJrLO 0 3 Ex 0.017569770 0.159205929 0.141636159 2 1: GGA PBEJsJrLO 0 4 Ex -0.052064758 0.108236129 0.160300887 2 1: GGA PBEJsJrHEG 0 1 Ex -1.113167924 -1.224855984 0.111688060 2 @@ -3732,6 +3662,8 @@ 1: GGA AM05 0 1 Ec -0.082798175 -0.076898025 0.005900150 2 1: GGA AM05 0 2 Ex -1.008120349 -0.896707254 0.111413095 2 1: GGA AM05 0 2 Ec -0.068136885 -0.074037035 0.005900150 2 +6: 2 4.000 0.004296443 -0.510231603 -0.510231603 -0.000000000 +7: 1 10.200 0.000000106 -0.027039672 -0.027041720 0.000002048 1: GGA AM05 0 3 Ex -0.045602766 0.048900587 0.094503353 2 1: GGA AM05 0 3 Ec 0.002856326 -0.003975501 0.006831827 2 1: GGA AM05 0 4 Ex 0.135135345 0.263518777 0.128383432 2 @@ -3744,7 +3676,6 @@ 1: GGA B88 0 2 Ex -0.995680782 -0.739800201 0.255880581 2 1: GGA B88 0 3 Ex -0.025777557 0.219674428 0.245451985 2 1: GGA B88 0 4 Ex 0.076387013 0.380829555 0.304442542 2 -7: 2 11.000 0.000000008 -0.020221667 -0.020223275 0.000001608 1: GGA C09 0 1 Ex -1.136146237 -1.267915024 0.131768787 2 1: GGA C09 0 2 Ex -1.076184699 -0.944415931 0.131768768 2 1: GGA C09 0 3 Ex 0.011681764 0.139540504 0.127858740 2 @@ -3762,6 +3693,7 @@ 1: GGA PW91 0 1 Ex -0.931258491 -0.804007936 0.127250555 2 1: GGA PW91 0 2 Ex -1.362544995 -1.489795538 0.127250542 2 1: GGA PW91 0 3 Ex -0.078162428 0.331774953 0.409937381 2 +6: 2 4.200 0.003500077 -0.479029886 -0.479029885 -0.000000000 1: GGA PW91 0 4 Ex 0.056466391 0.137948100 0.081481709 2 1: GGA PBE 0 1 Ex -0.953146068 -0.836211977 0.116934091 2 1: GGA PBE 0 2 Ex -1.364472804 -1.481406882 0.116934079 2 @@ -3771,13 +3703,13 @@ 1: GGA RPBE 0 2 Ex -1.358884455 -1.489045467 0.130161012 2 1: GGA RPBE 0 3 Ex -0.089559214 0.374736147 0.464295361 2 1: GGA RPBE 0 4 Ex 0.064699700 0.210310325 0.145610625 2 +7: 1 10.400 0.000000063 -0.025092806 -0.025094748 0.000001941 1: GGA revPBE 0 1 Ex -0.863768077 -0.735477071 0.128291006 2 1: GGA revPBE 0 2 Ex -1.359294926 -1.487585919 0.128290993 2 1: GGA revPBE 0 3 Ex -0.089804761 0.364926893 0.454731654 2 1: GGA revPBE 0 4 Ex 0.064877089 0.204390893 0.139513804 2 1: GGA LYP 0 1 Ex -0.876247866 -0.743890909 0.132356956 2 1: GGA LYP 0 1 Ec -0.121279256 -0.102906103 0.018373153 2 -7: 2 11.200 0.000000005 -0.018978407 -0.018979847 0.000001440 1: GGA LYP 0 2 Ex -1.361264612 -1.493621569 0.132356957 2 1: GGA LYP 0 2 Ec -0.035817283 -0.054190436 0.018373153 2 1: GGA LYP 0 3 Ex -0.087900006 0.358734346 0.446634352 2 @@ -3788,6 +3720,7 @@ 1: GGA WC 0 2 Ex -1.365979036 -1.474350797 0.108371761 2 1: GGA WC 0 3 Ex -0.084980325 0.271980367 0.356960691 2 1: GGA WC 0 4 Ex 0.061391802 0.141639063 0.080247262 2 +6: 2 4.400 0.002822947 -0.447492103 -0.447492104 0.000000001 1: GGA PBEJsJrLO 0 1 Ex -0.912659716 -0.825376843 0.087282872 2 1: GGA PBEJsJrLO 0 2 Ex -1.371888845 -1.459171705 0.087282860 2 1: GGA PBEJsJrLO 0 3 Ex -0.083226494 0.222363018 0.305589512 2 @@ -3805,9 +3738,10 @@ 1: GGA PBEGcGxHEG 0 3 Ex -0.078037495 0.154342658 0.232380154 2 1: GGA PBEGcGxHEG 0 4 Ex 0.056376137 0.115738635 0.059362498 2 1: GGA PBESOL 0 1 Ex -0.901149359 -0.827021353 0.074128006 2 +7: 1 10.600 0.000000037 -0.023372816 -0.023374647 0.000001831 1: GGA PBESOL 0 2 Ex -1.375318817 -1.449446810 0.074127993 2 1: GGA PBESOL 0 3 Ex -0.085934143 0.183401279 0.269335421 2 -7: 2 11.400 0.000000003 -0.017861495 -0.017862916 0.000001421 +6: 2 4.600 0.002254159 -0.415472518 -0.415472517 -0.000000001 1: GGA PBESOL 0 4 Ex 0.062080862 0.151810464 0.089729602 2 1: GGA AM05 0 1 Ex -0.848553718 -0.827630908 0.020922809 2 1: GGA AM05 0 1 Ec -0.107174657 -0.116444198 0.009269541 2 @@ -3835,6 +3769,7 @@ 1: GGA BH 0 4 Ex 0.085347411 0.270323979 0.184976568 2 1: 1: iSpin dens gradDens +6: 2 4.800 0.001782061 -0.382860808 -0.382860808 -0.000000000 1: 1 0.036487630 0.366673642 0.275484249 0.057500763 1: 2 0.045163246 -0.392901074 0.379663696 0.072582468 1: 3 -0.010202296 0.055585690 0.082666738 0.396233963 @@ -3846,9 +3781,8 @@ 1: GGA PBE 0 1 Ex -0.624497347 -0.564143567 0.060353780 2 1: GGA PBE 0 2 Ex -0.634058624 -0.694412405 0.060353781 2 1: GGA PBE 0 3 Ex 0.011243810 -0.057760031 0.069003841 2 +7: 1 10.800 0.000000022 -0.021841709 -0.021843441 0.000001732 1: GGA PBE 0 4 Ex 0.007216949 0.074743622 0.067526673 2 -7: 2 11.600 0.000000002 -0.016855994 -0.016857266 0.000001272 -7: avgDiffVxc, maxDiffVxc = 0.000000680 0.000002261 1: GGA RPBE 0 1 Ex -0.710782881 -0.686404091 0.024378790 2 1: GGA RPBE 0 2 Ex -0.742907104 -0.767285895 0.024378792 2 1: GGA RPBE 0 3 Ex 0.037777241 0.000677410 0.037099831 2 @@ -3866,6 +3800,7 @@ 1: GGA LYP 0 4 Ex 0.008124119 0.098653725 0.090529606 2 1: GGA LYP 0 4 Ec 0.002605460 0.468370682 0.465765222 2 1: GGA WC 0 1 Ex -0.610625431 -0.540613515 0.070011916 2 +6: 2 5.000 0.001394815 -0.349787495 -0.349787494 -0.000000001 1: GGA WC 0 2 Ex -0.610507917 -0.680519834 0.070011917 2 1: GGA WC 0 3 Ex -0.000138193 -0.083477500 0.083339307 2 1: GGA WC 0 4 Ex -0.000088701 0.083374513 0.083463214 2 @@ -3882,10 +3817,12 @@ 1: GGA PBEGcGxLO 0 3 Ex -0.004976451 -0.094731747 0.089755296 2 1: GGA PBEGcGxLO 0 4 Ex -0.003194184 0.081768639 0.084962823 2 1: GGA PBEGcGxHEG 0 1 Ex -0.544495908 -0.497698120 0.046797788 2 +7: 1 11.000 0.000000013 -0.020471625 -0.020473264 0.000001639 1: GGA PBEGcGxHEG 0 2 Ex -0.557184824 -0.603982613 0.046797788 2 1: GGA PBEGcGxHEG 0 3 Ex 0.014921832 -0.037761055 0.052682887 2 1: GGA PBEGcGxHEG 0 4 Ex 0.009577723 0.060656529 0.051078806 2 1: GGA PBESOL 0 1 Ex -0.571090556 -0.488252411 0.082838145 2 +6: 2 5.200 0.001080853 -0.316870200 -0.316870200 -0.000000000 1: GGA 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+7: 2 2.200 0.017336125 -0.757597743 -0.757597741 -0.000000002 1: GGA PBEGcGxLO 0 3 Ex 0.066915455 0.068896652 0.001981197 2 1: GGA PBEGcGxLO 0 4 Ex 0.010074877 -0.070385057 0.080459934 2 1: GGA PBEGcGxHEG 0 1 Ex -0.572178078 -0.551229077 0.020949001 2 @@ -4434,6 +4409,7 @@ 1: GGA PW86 0 1 Ex -0.591104470 -0.555753047 0.035351424 2 1: GGA PW86 0 2 Ex -0.624869188 -0.660220618 0.035351430 2 1: GGA PW86 0 3 Ex 0.040175672 0.033475674 0.006699998 2 +6: 2 9.600 0.000000313 -0.030299188 -0.030299098 -0.000000090 1: GGA PW86 0 4 Ex 0.006048901 -0.048116161 0.054165062 2 1: GGA B88 0 1 Ex -0.538739479 -0.503736757 0.035002722 2 1: GGA B88 0 2 Ex -0.596007691 -0.631010419 0.035002728 2 @@ -4447,6 +4423,7 @@ 1: GGA BH 0 2 Ex -0.568240815 -0.594732107 0.026491292 2 1: GGA BH 0 3 Ex 0.104810457 0.118953429 0.014142972 2 1: GGA BH 0 4 Ex 0.015780398 -0.152091311 0.167871709 2 +7: 2 2.400 0.015452834 -0.730277351 -0.730277348 -0.000000003 1: 1: iSpin dens gradDens 1: 1 0.000307293 0.000108623 -0.000061496 -0.001110645 @@ -4462,6 +4439,7 @@ 1: GGA PBE 0 3 Ex -0.009541249 -0.022473824 0.012932575 2 1: GGA PBE 0 4 Ex 0.010715135 -0.004846682 0.015561817 2 1: GGA RPBE 0 1 Ex -0.147421129 -0.147405209 0.000015920 2 +6: 2 9.800 0.000000193 -0.025795893 -0.025795813 -0.000000081 1: GGA RPBE 0 2 Ex -0.164137585 -0.164153502 0.000015917 2 1: GGA RPBE 0 3 Ex -0.015234794 -0.015259555 0.000024761 2 1: GGA RPBE 0 4 Ex 0.017109174 0.017079334 0.000029840 2 @@ -4485,7 +4463,9 @@ 1: GGA PBEJsJrLO 0 2 Ex -0.146973435 -0.158145697 0.011172262 2 1: GGA PBEJsJrLO 0 3 Ex -0.007456109 -0.024907372 0.017451263 2 1: GGA PBEJsJrLO 0 4 Ex 0.008373455 -0.012623875 0.020997329 2 +7: 2 2.600 0.013637077 -0.701421448 -0.701421449 0.000000001 1: GGA PBEJsJrHEG 0 1 Ex -0.122521219 -0.116854460 0.005666759 2 +6: 2 10.000 0.000000117 -0.021880577 -0.021880500 -0.000000077 1: GGA PBEJsJrHEG 0 2 Ex -0.132630047 -0.138296804 0.005666757 2 1: GGA PBEJsJrHEG 0 3 Ex -0.009212833 -0.018061403 0.008848570 2 1: GGA PBEJsJrHEG 0 4 Ex 0.010346314 -0.000301214 0.010647528 2 @@ -4509,6 +4489,7 @@ 1: GGA AM05 0 3 Ec 0.003866819 0.003967462 0.000100644 2 1: GGA AM05 0 4 Ex -0.017375217 -0.047928970 0.030553753 2 1: GGA AM05 0 4 Ec -0.004342564 -0.004221486 0.000121079 2 +6: 2 10.200 0.000000071 -0.018492378 -0.018492315 -0.000000063 1: GGA PW86 0 1 Ex -0.168056662 -0.158805735 0.009250927 2 1: GGA PW86 0 2 Ex -0.152726290 -0.161977220 0.009250930 2 1: GGA PW86 0 3 Ex 0.013971566 -0.034980730 0.048952296 2 @@ -4518,6 +4499,7 @@ 1: GGA B88 0 3 Ex 0.018454944 -0.053919189 0.072374132 2 1: GGA B88 0 4 Ex -0.020725507 -0.053159505 0.032433998 2 1: GGA C09 0 1 Ex -0.172347863 -0.156658768 0.015689096 2 +7: 2 2.800 0.011914930 -0.671294327 -0.671294326 -0.000000001 1: GGA C09 0 2 Ex -0.181562064 -0.197251157 0.015689093 2 1: GGA C09 0 3 Ex -0.008397501 -0.032783772 0.024386271 2 1: GGA C09 0 4 Ex 0.009430669 -0.019948491 0.029379159 2 @@ -4537,6 +4519,7 @@ 1: GGA PW91 0 4 Ex 0.004092851 0.014751301 0.010658450 2 1: GGA PBE 0 1 Ex -0.228533484 -0.228305865 0.000227620 2 1: GGA PBE 0 2 Ex -0.204809531 -0.205037139 0.000227608 2 +6: 2 10.400 0.000000042 -0.015573224 -0.015573163 -0.000000061 1: GGA PBE 0 3 Ex -0.000268871 -0.000037417 0.000231454 2 1: GGA PBE 0 4 Ex -0.008325657 -0.008657329 0.000331672 2 1: GGA revPBE 0 1 Ex -0.279293907 -0.278743689 0.000550218 2 @@ -4554,12 +4537,14 @@ 1: GGA WC 0 1 Ex -0.226948412 -0.226582563 0.000365849 2 1: GGA WC 0 2 Ex -0.203279465 -0.203645303 0.000365838 2 1: GGA WC 0 3 Ex -0.000268248 0.000010058 0.000278306 2 +7: 2 3.000 0.010306678 -0.640127830 -0.640127826 -0.000000003 1: GGA WC 0 4 Ex -0.008306353 -0.008836481 0.000530128 2 1: GGA PBEJsJrLO 0 1 Ex -0.226554636 -0.226222245 0.000332390 2 1: GGA PBEJsJrLO 0 2 Ex -0.202634216 -0.202966595 0.000332379 2 1: GGA PBEJsJrLO 0 3 Ex -0.000271098 0.000058349 0.000329447 2 1: GGA PBEJsJrLO 0 4 Ex -0.008394605 -0.008878714 0.000484109 2 1: GGA PBEJsJrHEG 0 1 Ex -0.197413435 -0.197257807 0.000155628 2 +6: 2 10.600 0.000000025 -0.013068736 -0.013068683 -0.000000052 1: GGA PBEJsJrHEG 0 2 Ex -0.177090712 -0.177246331 0.000155618 2 1: GGA PBEJsJrHEG 0 3 Ex -0.000230324 -0.000072028 0.000158295 2 1: GGA PBEJsJrHEG 0 4 Ex -0.007132033 -0.007358788 0.000226754 2 @@ -4580,10 +4565,12 @@ 1: GGA AM05 0 3 Ex -0.000233636 0.011772037 0.012005672 2 1: GGA AM05 0 3 Ec 0.000058232 0.000056317 0.000001916 2 1: GGA AM05 0 4 Ex -0.007234595 -0.088596805 0.081362211 2 +6: 2 10.800 0.000000015 -0.010928714 -0.010928690 -0.000000024 1: GGA PW86 0 1 Ex -0.223353766 -0.198562640 0.024791126 2 1: GGA PW86 0 2 Ex -0.194952309 -0.219743417 0.024791108 2 1: GGA PW86 0 3 Ex -0.000321883 0.005661927 0.005983810 2 1: GGA PW86 0 4 Ex -0.009967175 -0.045481406 0.035514231 2 +7: 2 3.200 0.008826792 -0.608140908 -0.608140904 -0.000000003 1: GGA B88 0 1 Ex -0.185456621 -0.098779493 0.086677128 2 1: GGA B88 0 2 Ex -0.160431430 -0.247108525 0.086677094 2 1: GGA B88 0 3 Ex -0.000283618 0.017696105 0.017979723 2 @@ -4596,6 +4583,7 @@ 1: GGA BH 0 2 Ex -0.197596738 -0.221622912 0.024026173 2 1: GGA BH 0 3 Ex -0.000319145 0.005422622 0.005741767 2 1: GGA BH 0 4 Ex -0.009882415 -0.044298991 0.034416576 2 +6: 2 11.000 0.000000008 -0.009107337 -0.009107277 -0.000000060 1: 1: iSpin dens gradDens 1: 1 0.000000000 -0.000000001 0.000000000 0.000000001 @@ -4606,6 +4594,8 @@ 1: GGA LYP 0 1 Ec -0.000399843 -0.001206934 0.000807091 2 1: GGA LYP 0 2 Ex 0.000000000 -0.004009514 0.004009514 2 1: GGA LYP 0 2 Ec -0.000399843 -0.001206934 0.000807091 2 +7: 2 3.400 0.007484177 -0.575559240 -0.575559246 0.000000006 +6: 2 11.200 0.000000005 -0.007563161 -0.007563174 0.000000013 1: GGA AM05 0 1 Ex -0.023038960 0.811771855 0.834810816 2 1: GGA AM05 0 2 Ex -0.022981484 -0.857792300 0.834810816 2 1: GGA AM05 0 3 Ex 0.000794355 0.319393862 0.318599507 2 @@ -4626,6 +4616,8 @@ 1: iSpin dens gradDens 1: 1 1.917786045 -4.673231096 -4.136315021 -12.748841924 1: 2 1.775368832 6.675702482 15.711827234 6.202183980 +6: 2 11.400 0.000000003 -0.006258998 -0.006258965 -0.000000033 +7: 2 3.600 0.006282640 -0.542620903 -0.542620905 0.000000002 1: 3 -0.050938230 -4.686275989 12.944867619 4.788671915 1: 4 0.142428659 -14.146602308 -10.562647373 -14.480169970 1: GGA PW91 0 1 Ex -1.429491870 -1.912553821 0.483061951 2 @@ -4652,6 +4644,8 @@ 1: GGA LYP 0 3 Ec -0.005276990 -0.021497109 0.016220119 2 1: GGA LYP 0 4 Ex -0.039941309 0.263671029 0.303612339 2 1: GGA LYP 0 4 Ec 0.014755021 -0.005753713 0.020508734 2 +6: 2 11.600 0.000000002 -0.005161710 -0.005161583 -0.000000127 +6: avgDiffVxc, maxDiffVxc = 0.000000036 0.000000274 1: GGA WC 0 1 Ex -1.417300440 -1.843877034 0.426576594 2 1: GGA WC 0 2 Ex -1.365440720 -0.938864132 0.426576589 2 1: GGA WC 0 3 Ex 0.018548617 0.056068473 0.037519856 2 @@ -4661,6 +4655,7 @@ 1: GGA PBEJsJrLO 0 3 Ex 0.002007472 0.018701244 0.016693772 2 1: GGA PBEJsJrLO 0 4 Ex -0.005613104 0.210488951 0.216102055 2 1: GGA PBEJsJrHEG 0 1 Ex -1.473530801 -1.790097200 0.316566399 2 +7: 2 3.800 0.005221523 -0.509578436 -0.509578436 -0.000000000 1: GGA PBEJsJrHEG 0 2 Ex -1.480418114 -1.163851720 0.316566394 2 1: GGA PBEJsJrHEG 0 3 Ex -0.002463379 0.000416908 0.002880287 2 1: GGA PBEJsJrHEG 0 4 Ex 0.006887867 0.166188387 0.159300521 2 @@ -4676,6 +4671,7 @@ 1: GGA PBESOL 0 2 Ex -1.374497135 -0.984347208 0.390149927 2 1: GGA PBESOL 0 3 Ex 0.007508601 0.028955210 0.021446609 2 1: GGA PBESOL 0 4 Ex -0.020994839 0.181734556 0.202729395 2 +3/9 Test #6: libgridxc_test_libxc ............. Passed 0.07 sec 1: GGA AM05 0 1 Ex -1.339655204 -1.658427184 0.318771980 2 1: GGA AM05 0 1 Ec -0.079514682 -0.075837045 0.003677637 2 1: GGA AM05 0 2 Ex -1.272836548 -0.954064567 0.318771980 2 @@ -4698,6 +4694,7 @@ 1: GGA C09 0 4 Ex -0.089044531 0.175227504 0.264272035 2 1: GGA BH 0 1 Ex -1.208428632 -1.810278959 0.601850327 2 1: GGA BH 0 2 Ex -1.085747353 -0.483897032 0.601850322 2 +7: 2 4.000 0.004296443 -0.476699712 -0.476699710 -0.000000003 1: GGA BH 0 3 Ex 0.043879297 0.128376111 0.084496815 2 1: GGA BH 0 4 Ex -0.122691139 0.208429236 0.331120375 2 1: @@ -4735,6 +4732,7 @@ 1: GGA WC 0 3 Ex 0.028773353 9.876884043 9.848110691 2 1: GGA WC 0 4 Ex 0.032220085 -4.737852663 4.770072748 2 1: GGA PBEJsJrLO 0 1 Ex -0.683386836 0.591099867 1.274486703 2 +7: 2 4.200 0.003500077 -0.444266875 -0.444266874 -0.000000001 1: GGA PBEJsJrLO 0 2 Ex -0.528124860 -1.802611574 1.274486714 2 1: GGA PBEJsJrLO 0 3 Ex 0.023072079 9.272394747 9.249322667 2 1: GGA PBEJsJrLO 0 4 Ex 0.025835862 -4.404495776 4.430331637 2 @@ -4768,6 +4766,7 @@ 1: GGA PW86 0 4 Ex 0.014575252 -5.139640003 5.154215255 2 1: GGA B88 0 1 Ex -0.514782290 2.529957592 3.044739882 2 1: GGA B88 0 2 Ex -0.486004164 -3.530744058 3.044739893 2 +7: 2 4.400 0.002822947 -0.412572354 -0.412572354 -0.000000000 1: GGA B88 0 3 Ex 0.004276457 20.303231090 20.298954633 2 1: GGA B88 0 4 Ex 0.004788730 -8.973929107 8.978717837 2 1: GGA C09 0 1 Ex -0.487889001 2.232498889 2.720387890 2 @@ -4806,6 +4805,7 @@ 1: GGA LYP 0 2 Ec -0.097922715 -0.135315655 0.037392941 2 1: GGA LYP 0 3 Ex -0.068843745 -0.272058249 0.203214505 2 1: GGA LYP 0 3 Ec 0.047175167 0.038900457 0.008274710 2 +7: 2 4.600 0.002254159 -0.381911080 -0.381911079 -0.000000000 1: GGA LYP 0 4 Ex 0.049970111 -0.022096306 0.072066417 2 1: GGA LYP 0 4 Ec -0.034242012 -0.098906461 0.064664449 2 1: GGA WC 0 1 Ex -1.394819120 -1.443456181 0.048637060 2 @@ -4836,6 +4836,7 @@ 1: GGA AM05 0 1 Ec -0.085167829 -0.084871105 0.000296724 2 1: GGA AM05 0 2 Ex -1.154092906 -1.060242888 0.093850018 2 1: GGA AM05 0 2 Ec -0.068003632 -0.068300356 0.000296724 2 +7: 2 4.800 0.001782061 -0.352568553 -0.352568554 0.000000001 1: GGA AM05 0 3 Ex -0.107237462 -0.220940916 0.113703454 2 1: GGA AM05 0 3 Ec 0.008300424 0.009599681 0.001299257 2 1: GGA AM05 0 4 Ex 0.077838123 0.054873754 0.022964369 2 @@ -4874,6 +4875,7 @@ 1: GGA RPBE 0 2 Ex -0.355195924 -0.355193359 0.000002565 2 1: GGA RPBE 0 3 Ex 0.072561660 0.072542433 0.000019228 2 1: GGA RPBE 0 4 Ex 0.030363393 0.030407530 0.000044138 2 +7: 2 5.000 0.001394815 -0.324805491 -0.324805493 0.000000001 1: GGA revPBE 0 1 Ex -0.425452141 -0.427400243 0.001948102 2 1: GGA revPBE 0 2 Ex -0.399755741 -0.397807660 0.001948081 2 1: GGA revPBE 0 3 Ex 0.043491372 0.028430666 0.015060706 2 @@ -4904,6 +4906,7 @@ 1: GGA PBEGcGxLO 0 4 Ex 0.016284344 0.041021645 0.024737301 2 1: GGA PBEGcGxHEG 0 1 Ex -0.316963927 -0.317683924 0.000719997 2 1: GGA PBEGcGxHEG 0 2 Ex -0.290186190 -0.289466207 0.000719983 2 +7: 2 5.200 0.001080853 -0.298841517 -0.298841517 -0.000000000 1: GGA PBEGcGxHEG 0 3 Ex 0.045321543 0.039765002 0.005556541 2 1: GGA PBEGcGxHEG 0 4 Ex 0.018964778 0.031735359 0.012770581 2 1: GGA PBESOL 0 1 Ex -0.347729282 -0.349119615 0.001390333 2 @@ -4941,6 +4944,7 @@ 1: 3 0.033580387 1.887861733 4.947897896 1.321180513 1: 4 0.133980128 -6.011190247 1.403576936 2.832298879 1: GGA PW91 0 1 Ex -1.283892290 -1.398635074 0.114742783 2 +7: 2 5.400 0.000829225 -0.274842954 -0.274842954 0.000000000 1: GGA PW91 0 2 Ex -1.167522968 -1.052780181 0.114742786 2 1: GGA PW91 0 3 Ex -0.013342336 -0.088624019 0.075281683 2 1: GGA PW91 0 4 Ex -0.053233691 0.091049112 0.144282804 2 @@ -4972,6 +4976,7 @@ 1: GGA PBEJsJrLO 0 2 Ex -1.174688917 -1.081773629 0.092915288 2 1: GGA PBEJsJrLO 0 3 Ex -0.013805832 -0.074708104 0.060902272 2 1: GGA PBEJsJrLO 0 4 Ex -0.055082962 0.061738277 0.116821239 2 +7: 2 5.600 0.000629844 -0.252923338 -0.252923338 0.000000000 1: GGA PBEJsJrHEG 0 1 Ex -1.301598580 -1.384803383 0.083204803 2 1: GGA PBEJsJrHEG 0 2 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0 4 Ex 0.050188932 0.067126242 0.016937310 2 1: GGA PBEJsJrHEG 0 1 Ex -1.282645346 -1.206354760 0.076290586 2 @@ -5938,6 +5970,7 @@ 1: GGA PW86 0 4 Ex 0.126669969 0.152802310 0.026132341 2 1: GGA B88 0 1 Ex -1.132193268 -0.968680806 0.163512462 2 1: GGA B88 0 2 Ex -1.057428557 -1.220941001 0.163512444 2 +7: 2 11.200 0.000000005 -0.018978407 -0.018979847 0.000001440 1: GGA B88 0 3 Ex 0.041172605 -0.016005465 0.057178069 2 1: GGA B88 0 4 Ex 0.235629774 0.271561772 0.035931998 2 1: GGA C09 0 1 Ex -1.402752204 -1.321311559 0.081440645 2 @@ -5974,6 +6007,7 @@ 1: GGA LYP 0 1 Ec -0.462244994 -0.509490797 0.047245803 2 1: GGA LYP 0 2 Ex -0.550240557 -0.441504145 0.108736413 2 1: GGA LYP 0 2 Ec -0.071466379 -0.024220576 0.047245803 2 +7: 2 11.400 0.000000003 -0.017861495 -0.017862916 0.000001421 1: GGA LYP 0 3 Ex -0.008166070 -0.469204497 0.461038427 2 1: GGA LYP 0 3 Ec 0.079250964 0.250227270 0.170976306 2 1: GGA LYP 0 4 Ex 0.008530545 -0.176179529 0.184710074 2 @@ -6004,8 +6038,10 @@ 1: GGA PBESOL 0 4 Ex -0.025168964 0.033676511 0.058845475 2 1: GGA AM05 0 1 Ex -0.442053997 -0.488465055 0.046411059 2 1: GGA AM05 0 1 Ec -0.064069927 -0.061507456 0.002562472 2 +7: 2 11.600 0.000000002 -0.016855994 -0.016857266 0.000001272 1: GGA AM05 0 2 Ex -0.546851216 -0.500440157 0.046411059 2 1: GGA AM05 0 2 Ec -0.052199801 -0.054762273 0.002562472 2 +7: avgDiffVxc, maxDiffVxc = 0.000000680 0.000002261 1: GGA AM05 0 3 Ex -0.021253161 -0.304873308 0.283620147 2 1: GGA AM05 0 3 Ec 0.002407294 0.005202253 0.002794959 2 1: GGA AM05 0 4 Ex 0.022201750 -0.139765194 0.161966944 2 @@ -6039,6 +6075,7 @@ 1: GGA PBE 0 1 Ex -1.164311108 -1.207015377 0.042704269 2 1: GGA PBE 0 2 Ex -1.240108614 -1.197404336 0.042704278 2 1: GGA PBE 0 3 Ex 0.142851221 0.129231223 0.013619998 2 +4/9 Test #7: libgridxc_test_libxc2 ............ Passed 0.09 sec 1: GGA PBE 0 4 Ex -0.182885831 -0.202373798 0.019487967 2 1: GGA RPBE 0 1 Ex -1.165486189 -1.209922331 0.044436142 2 1: GGA RPBE 0 2 Ex -1.240156732 -1.195720581 0.044436151 2 @@ -6488,6 +6525,7 @@ 1: GGA B88 0 2 Ex -0.428949725 -0.464949684 0.035999959 2 1: GGA B88 0 3 Ex 0.000010188 0.040053183 0.040042995 2 1: GGA B88 0 4 Ex -0.000187326 0.031465296 0.031652622 2 +5/9 Test #5: libgridxc_test6 .................. Passed 0.11 sec 1: GGA C09 0 1 Ex -0.538522253 -0.556730483 0.018208229 2 1: GGA C09 0 2 Ex -0.408170801 -0.389962551 0.018208251 2 1: GGA C09 0 3 Ex -0.004329402 0.089235767 0.093565169 2 @@ -9394,7 +9432,7 @@ 1: GGA revPBE 0 2 Ex -1.609132434 -1.586787187 0.022345248 2 1: GGA revPBE 0 3 Ex -0.097358450 -0.089434280 0.007924170 2 1: GGA revPBE 0 4 Ex 0.050147058 0.225498708 0.175351650 2 -1: GGA LYP 0 1 Ex -2.162622856 -2.184724782 0.022101925 2 +1: GGA LYP 0 1 Ex -2.162622856 -2.184724778 0.022101922 2 1: GGA LYP 0 1 Ec -0.389580178 -0.404057081 0.014476903 2 1: GGA LYP 0 2 Ex -1.657115678 -1.635013756 0.022101922 2 1: GGA LYP 0 2 Ec -0.047515105 -0.033038203 0.014476902 2 @@ -9455,9 +9493,7 @@ 1: error 1 => V=dE/dDens is positive 1: error 2 => analytical and numerical value of dE/dDens differ 1: error 3 => analytical and numerical value of dE/dGradDens differ -4/9 Test #1: libgridxc_test1 .................. Passed 0.39 sec -5/9 Test #7: libgridxc_test_libxc2 ............ Passed 0.35 sec -6/9 Test #5: libgridxc_test6 .................. Passed 0.64 sec +6/9 Test #1: libgridxc_test1 .................. Passed 0.18 sec 2: 2: funcs= VDW 2: auths= BH @@ -9466,53 +9502,53 @@ 2: 1 0.000 0.047620227 -0.999477920 2: 1 0.200 0.047382720 -0.999360161 -1.000195026 0.000834865 2: 1 0.400 0.046677283 -0.999006885 -0.998709202 -0.000297683 +2: 1 0.600 0.045524817 -0.987412253 -0.987507999 0.000095746 3: Ex, Ec = -3.716289981 -0.771674483 3: Dx, Dc = 1.192543612 0.121155159 -2: 1 0.600 0.045524817 -0.987412253 -0.987508059 0.000095805 2: 1 0.800 0.043959010 -0.980158453 -0.980143398 -0.000015055 2: 1 1.000 0.042024703 -0.963929151 -0.963927492 -0.000001659 -2: 1 1.200 0.039775757 -0.949006509 -0.949005827 -0.000000682 -3: i1 i2 i3 iSpin Vxc dExc/dDens diff -3: 2 8 13 2 -0.313847006 -0.313846988 -0.000000018 +2: 1 1.200 0.039775757 -0.949006509 -0.949005812 -0.000000697 2: 1 1.400 0.037272568 -0.929353368 -0.929356359 0.000002991 2: 1 1.600 0.034579382 -0.908100586 -0.908099063 -0.000001523 2: 1 1.800 0.031761587 -0.884442948 -0.884442165 -0.000000783 +3: i1 i2 i3 iSpin Vxc dExc/dDens diff +3: 2 8 13 2 -0.313847006 -0.313846990 -0.000000016 2: 1 2.000 0.028883127 -0.858808538 -0.858809374 0.000000836 2: 1 2.200 0.026004187 -0.831341143 -0.831341125 -0.000000017 -3: 4 2 23 2 -0.524218962 -0.524218947 -0.000000014 2: 1 2.400 0.023179251 -0.802320622 -0.802320395 -0.000000227 -2: 1 2.600 0.020455616 -0.772056571 -0.772056926 0.000000355 +2: 1 2.600 0.020455616 -0.772056571 -0.772056924 0.000000353 2: 1 2.800 0.017872394 -0.740675199 -0.740674874 -0.000000326 2: 1 3.000 0.015460016 -0.708430779 -0.708429554 -0.000001224 +3: 4 2 23 2 -0.524218962 -0.524218950 -0.000000011 2: 1 3.200 0.013240188 -0.675669578 -0.675674006 0.000004429 -3: 5 6 2 1 -0.626312320 -0.626312328 0.000000008 2: 1 3.400 0.011226266 -0.642459702 -0.642454691 -0.000005011 2: 1 3.600 0.009423960 -0.609091304 -0.609092448 0.000001144 2: 1 3.800 0.007832284 -0.575839731 -0.575841531 0.000001800 2: 1 4.000 0.006444664 -0.542697531 -0.542696462 -0.000001069 2: 1 4.200 0.005250115 -0.510078329 -0.510077513 -0.000000816 -3: 4 2 9 2 -0.561691010 -0.561691005 -0.000000005 +3: 5 6 2 1 -0.626312320 -0.626312325 0.000000005 2: 1 4.400 0.004234421 -0.478003232 -0.478007540 0.000004308 2: 1 4.600 0.003381238 -0.446577649 -0.446566566 -0.000011083 2: 1 4.800 0.002673091 -0.416186718 -0.416202730 0.000016011 -2: 1 5.000 0.002092223 -0.386734472 -0.386724841 -0.000009631 +2: 1 5.000 0.002092223 -0.386734472 -0.386724842 -0.000009630 2: 1 5.200 0.001621280 -0.359258071 -0.359253814 -0.000004257 -2: 1 5.400 0.001243837 -0.329009264 -0.329019030 0.000009766 -3: 7 3 21 1 -0.491741169 -0.491741176 0.000000007 +2: 1 5.400 0.001243837 -0.329009264 -0.329019031 0.000009767 +3: 4 2 9 2 -0.561691010 -0.561691005 -0.000000005 2: 1 5.600 0.000944766 -0.268263860 -0.268258610 -0.000005250 2: 1 5.800 0.000710460 -0.184072378 -0.184073422 0.000001044 2: 1 6.000 0.000528944 -0.147193854 -0.147194457 0.000000604 2: 1 6.200 0.000389881 -0.169127143 -0.169125287 -0.000001857 -3: 1 2 0 2 -0.680189858 -0.680189871 0.000000013 2: 1 6.400 0.000284517 -0.195915387 -0.195917509 0.000002122 2: 1 6.600 0.000205559 -0.203472102 -0.203471426 -0.000000676 +3: 7 3 21 1 -0.491741169 -0.491741176 0.000000007 2: 1 6.800 0.000147033 -0.198598658 -0.198597592 -0.000001066 2: 1 7.000 0.000104122 -0.189565923 -0.189567430 0.000001507 -2: 1 7.200 0.000072999 -0.181016372 -0.181015280 -0.000001093 +2: 1 7.200 0.000072999 -0.181016372 -0.181015279 -0.000001093 2: 1 7.400 0.000050669 -0.173604245 -0.173604994 0.000000748 2: 1 7.600 0.000034818 -0.165710223 -0.165709116 -0.000001107 2: 1 7.800 0.000023687 -0.155572229 -0.155573540 0.000001310 2: 1 8.000 0.000015954 -0.142174017 -0.142175066 0.000001050 +3: 1 2 0 2 -0.680189858 -0.680189869 0.000000011 2: 1 8.200 0.000010638 -0.126477393 -0.126473509 -0.000003883 2: 1 8.400 0.000007022 -0.110553043 -0.110555104 0.000002060 2: 1 8.600 0.000004589 -0.096226748 -0.096227608 0.000000861 @@ -9521,11 +9557,11 @@ 2: 1 9.200 0.000001206 -0.066227937 -0.066230345 0.000002408 2: 1 9.400 0.000000757 -0.059254673 -0.059259092 0.000004419 2: 1 9.600 0.000000470 -0.053256096 -0.053258876 0.000002780 -2: 1 9.800 0.000000289 -0.047889328 -0.047892333 0.000003005 -2: 1 10.000 0.000000176 -0.043050812 -0.043053583 0.000002771 +2: 1 9.800 0.000000289 -0.047889328 -0.047892332 0.000003004 +2: 1 10.000 0.000000176 -0.043050812 -0.043053581 0.000002770 2: 1 10.200 0.000000106 -0.038722914 -0.038725315 0.000002401 2: 1 10.400 0.000000063 -0.034770816 -0.034772940 0.000002124 -2: 1 10.600 0.000000037 -0.031177334 -0.031179205 0.000001871 +2: 1 10.600 0.000000037 -0.031177334 -0.031179208 0.000001875 2: 1 10.800 0.000000022 -0.027908137 -0.027909793 0.000001656 2: 1 11.000 0.000000013 -0.024937534 -0.024938986 0.000001452 2: 1 11.200 0.000000007 -0.022242269 -0.022243485 0.000001216 @@ -9535,7 +9571,7 @@ 2: iSpin r dens Vxc dExc/dDens diff 2: 2 0.000 0.031746818 -0.915508806 2: 2 0.200 0.031588480 -0.915751674 -0.916585922 0.000834248 -2: 2 0.400 0.031118189 -0.916480278 -0.916182637 -0.000297641 +2: 2 0.400 0.031118189 -0.916480278 -0.916182876 -0.000297402 2: 2 0.600 0.030349878 -0.905234497 -0.905330241 0.000095744 2: 2 0.800 0.029306007 -0.899618247 -0.899603188 -0.000015059 2: 2 1.000 0.028016469 -0.884545454 -0.884543777 -0.000001678 @@ -9544,11 +9580,11 @@ 2: 2 1.600 0.023052921 -0.835057592 -0.835056067 -0.000001525 2: 2 1.800 0.021174391 -0.813963082 -0.813962307 -0.000000775 2: 2 2.000 0.019255418 -0.791103995 -0.791104838 0.000000843 -2: 2 2.200 0.017336125 -0.766590785 -0.766590763 -0.000000022 +2: 2 2.200 0.017336125 -0.766590785 -0.766590767 -0.000000019 2: 2 2.400 0.015452834 -0.740674175 -0.740673952 -0.000000223 2: 2 2.600 0.013637077 -0.713633471 -0.713633830 0.000000358 -2: 2 2.800 0.011914930 -0.685564496 -0.685564170 -0.000000327 -2: 2 3.000 0.010306678 -0.656691901 -0.656690678 -0.000001223 +2: 2 2.800 0.011914930 -0.685564496 -0.685564177 -0.000000319 +2: 2 3.000 0.010306678 -0.656691901 -0.656690674 -0.000001227 2: 2 3.200 0.008826792 -0.627334141 -0.627338570 0.000004429 2: 2 3.400 0.007484177 -0.597534542 -0.597529527 -0.000005015 2: 2 3.600 0.006282640 -0.567562765 -0.567563909 0.000001144 @@ -9557,7 +9593,7 @@ 2: 2 4.200 0.003500077 -0.478500307 -0.478499491 -0.000000816 2: 2 4.400 0.002822947 -0.449602251 -0.449606559 0.000004309 2: 2 4.600 0.002254159 -0.421308745 -0.421297663 -0.000011082 -2: 2 4.800 0.001782061 -0.394081537 -0.394097550 0.000016013 +2: 2 4.800 0.001782061 -0.394081537 -0.394097551 0.000016013 2: 2 5.000 0.001394815 -0.368503162 -0.368493534 -0.000009629 2: 2 5.200 0.001080853 -0.338654863 -0.338650607 -0.000004257 2: 2 5.400 0.000829225 -0.277895720 -0.277905487 0.000009767 @@ -9569,8 +9605,8 @@ 2: 2 6.600 0.000137039 -0.206427971 -0.206427295 -0.000000676 2: 2 6.800 0.000098022 -0.195576084 -0.195575020 -0.000001064 2: 2 7.000 0.000069415 -0.184792808 -0.184794315 0.000001507 -2: 2 7.200 0.000048666 -0.176119925 -0.176118834 -0.000001092 -2: 2 7.400 0.000033779 -0.169045503 -0.169046255 0.000000752 +2: 2 7.200 0.000048666 -0.176119925 -0.176118833 -0.000001092 +2: 2 7.400 0.000033779 -0.169045503 -0.169046254 0.000000751 2: 2 7.600 0.000023212 -0.161554180 -0.161553078 -0.000001102 2: 2 7.800 0.000015792 -0.151793526 -0.151794848 0.000001322 2: 2 8.000 0.000010636 -0.138751509 -0.138752581 0.000001072 @@ -9581,8 +9617,19 @@ 2: 2 9.000 0.000001268 -0.072533230 -0.072536399 0.000003169 2: 2 9.200 0.000000804 -0.064613896 -0.064617440 0.000003544 2: 2 9.400 0.000000504 -0.057796389 -0.057800206 0.000003817 -2: 2 9.600 0.000000313 -0.051913010 -0.051915903 0.000002893 +2: 2 9.600 0.000000313 -0.051913010 -0.051915902 0.000002892 2: 2 9.800 0.000000193 -0.046631823 -0.046634642 0.000002819 +2: 2 10.000 0.000000117 -0.041859516 -0.041862067 0.000002550 +2: 2 10.200 0.000000071 -0.037586671 -0.037588904 0.000002233 +2: 2 10.400 0.000000042 -0.033684342 -0.033686318 0.000001976 +2: 2 10.600 0.000000025 -0.030139120 -0.030140869 0.000001749 +2: 2 10.800 0.000000015 -0.026918806 -0.026920326 0.000001520 +2: 2 11.000 0.000000008 -0.023998661 -0.024000004 0.000001343 +2: 2 11.200 0.000000005 -0.021355613 -0.021356881 0.000001268 +2: 2 11.400 0.000000003 -0.018968230 -0.018969178 0.000000948 +2: 2 11.600 0.000000002 -0.016816386 -0.016817212 0.000000826 +2: avgDiffVxc, maxDiffVxc = 0.000088733 0.000834865 +7/9 Test #2: libgridxc_test2 .................. Passed 7.59 sec 4: 4: funcs= VDW 4: auths= BH @@ -9592,19 +9639,8 @@ 4: atomEc, cellEc, diff = -0.679499275 -0.679753307 0.000254032 4: atomDx, cellDx, diff = 1.349799036 1.349797201 0.000001835 4: atomDc, cellDc, diff = 0.155982425 0.155866069 0.000116356 -2: 2 10.000 0.000000117 -0.041859516 -0.041862067 0.000002550 4: avgDiffVxc, maxDiffVxc = 0.000006162 0.038047291 -7/9 Test #4: libgridxc_test4 .................. Passed 18.37 sec -2: 2 10.200 0.000000071 -0.037586671 -0.037588902 0.000002231 -2: 2 10.400 0.000000042 -0.033684342 -0.033686321 0.000001979 -2: 2 10.600 0.000000025 -0.030139120 -0.030140869 0.000001749 -2: 2 10.800 0.000000015 -0.026918806 -0.026920311 0.000001505 -2: 2 11.000 0.000000008 -0.023998661 -0.023999989 0.000001328 -2: 2 11.200 0.000000005 -0.021355613 -0.021356881 0.000001268 -2: 2 11.400 0.000000003 -0.018968230 -0.018969119 0.000000889 -2: 2 11.600 0.000000002 -0.016816386 -0.016817212 0.000000826 -2: avgDiffVxc, maxDiffVxc = 0.000088737 0.000834865 -8/9 Test #2: libgridxc_test2 .................. Passed 18.75 sec +8/9 Test #4: libgridxc_test4 .................. Passed 7.66 sec 3: xc stress * volume = 3: -4.405894836 -0.011039400 0.003122993 3: -0.011039400 -4.442866097 0.004079677 @@ -9617,11 +9653,11 @@ 3: 0.000022309 -0.000006705 0.000059142 3: -0.000006705 0.000002015 -0.000017774 3: 0.000059142 -0.000017774 0.000156789 -9/9 Test #3: libgridxc_test3 .................. Passed 24.54 sec +9/9 Test #3: libgridxc_test3 .................. Passed 10.34 sec 100% tests passed, 0 tests failed out of 9 -Total Test time (real) = 24.65 sec +Total Test time (real) = 10.34 sec make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' create-stamp debian/debhelper-build-stamp fakeroot debian/rules binary @@ -9629,7 +9665,7 @@ dh_testroot -O--buildsystem=cmake dh_prep -O--buildsystem=cmake dh_auto_install --destdir=debian/libgridxc-dev/ -O--buildsystem=cmake - cd obj-x86_64-linux-gnu && make -j20 install DESTDIR=/build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev AM_UPDATE_INFO_DIR=no "INSTALL=install --strip-program=true" + cd obj-x86_64-linux-gnu && make -j42 install DESTDIR=/build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev AM_UPDATE_INFO_DIR=no "INSTALL=install --strip-program=true" make[1]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' /usr/bin/cmake -S/build/reproducible-path/libgridxc-2.0.2 -B/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu --check-build-system CMakeFiles/Makefile.cmake 0 /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/CMakeFiles /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu//CMakeFiles/progress.marks @@ -9650,15 +9686,15 @@ make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/depend make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/depend make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/depend -make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend -make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/depend -make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/DependInfo.cmake "--color=" +make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/depend cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/DependInfo.cmake "--color=" +make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' @@ -9673,58 +9709,58 @@ cd /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake "--color=" make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/build +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/build make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/build -make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/build -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test2.dir/build'. +make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/build +make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_libxc.dir/build'. +make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_libxc2.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/build +make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/build +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/build +make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test3.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -[ 68%] Built target libgridxc-test2 -[ 72%] Built target libgridxc-test3 -[ 76%] Built target libgridxc-test_libxc2 -[ 80%] Built target libgridxc-test_libxc -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/build -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/build +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test2.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/build +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test1.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_match.dir/build'. +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test4.dir/build'. +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test6.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_hse06.dir/build'. +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_libxc2.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_match.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test4.dir/build'. +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_hse06.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test1.dir/build'. +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_libxc.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' -[ 84%] Built target libgridxc-test_hse06 -[ 88%] Built target libgridxc-test6 -[ 92%] Built target libgridxc-test_match -[ 96%] Built target libgridxc-test4 -[100%] Built target libgridxc-test1 +[ 68%] Built target libgridxc-test2 +[ 84%] Built target libgridxc-test3 +[ 84%] Built target libgridxc-test4 +[ 84%] Built target libgridxc-test1 +[ 86%] Built target libgridxc-test6 +[ 92%] Built target libgridxc-test_libxc2 +[ 92%] Built target libgridxc-test_hse06 +[ 98%] Built target libgridxc-test_match +[100%] Built target libgridxc-test_libxc make[2]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu/CMakeFiles 0 make -f CMakeFiles/Makefile2 preinstall @@ -9741,40 +9777,40 @@ -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/lib/x86_64-linux-gnu/cmake/libgridxc/libgridxc-targets.cmake -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/lib/x86_64-linux-gnu/cmake/libgridxc/libgridxc-targets-relwithdebinfo.cmake -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0 --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gpfa_core_sp.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_minvec.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_chkgmx.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_atom.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gpfa_core_dp.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_cellsubs.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_hybrids.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_bessph.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_mesh3d.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_sorting.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_am05.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_xcmod.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_debugxc.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_lda.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_precision.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_vdwxc.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_mesh1d.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fftr.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_array.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fft_gpfa.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_vv_vdwxc.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_sys.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_interpolation.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_moreparallelsubs.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_radfft.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_vdwxc.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_cell.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_atom.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_walltime.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_io.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_alloc.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_array.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_radfft.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_config.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_cell.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_mesh3d.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_xwpbe.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_hybrids.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gpfa_core_sp.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fft3d.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_minvec.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_io.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_interpolation.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fftr.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_debugxc.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fft_gpfa.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gga.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_mesh1d.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_chkgmx.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_lda.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_am05.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_sorting.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_moreparallelsubs.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_bessph.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_precision.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_cellsubs.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_alloc.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/share/licenses/libgridxc/COPYING make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-x86_64-linux-gnu' dh_installdocs -O--buildsystem=cmake @@ -9804,12 +9840,14 @@ dpkg-buildpackage: info: binary-only upload (no source included) dpkg-genchanges: info: including full source code in upload I: copying local configuration +I: user script /srv/workspace/pbuilder/1082461/tmp/hooks/B01_cleanup starting +I: user script /srv/workspace/pbuilder/1082461/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/818019 and its subdirectories -I: Current time: Sun Dec 8 15:41:10 -12 2024 -I: pbuilder-time-stamp: 1733715670 +I: removing directory /srv/workspace/pbuilder/1082461 and its subdirectories +I: Current time: Mon Jan 12 00:05:21 +14 2026 +I: pbuilder-time-stamp: 1768125921