Diff of the two buildlogs: -- --- b1/build.log 2024-06-06 18:34:38.319284811 +0000 +++ b2/build.log 2024-06-07 10:28:12.889053755 +0000 @@ -1,6 +1,6 @@ I: pbuilder: network access will be disabled during build -I: Current time: Thu Jun 6 05:32:26 -12 2024 -I: pbuilder-time-stamp: 1717695146 +I: Current time: Thu Jul 10 14:57:43 +14 2025 +I: pbuilder-time-stamp: 1752109063 I: Building the build Environment I: extracting base tarball [/var/cache/pbuilder/trixie-reproducible-base.tgz] I: copying local configuration @@ -32,52 +32,84 @@ dpkg-source: info: applying set_madness_revision_eee5fd9f.patch I: Not using root during the build. I: Installing the build-deps -I: user script /srv/workspace/pbuilder/2285845/tmp/hooks/D02_print_environment starting +I: user script /srv/workspace/pbuilder/3423284/tmp/hooks/D01_modify_environment starting +debug: Running on ionos15-amd64. +I: Changing host+domainname to test build reproducibility +I: Adding a custom variable just for the fun of it... +I: Changing /bin/sh to bash +'/bin/sh' -> '/bin/bash' +lrwxrwxrwx 1 root root 9 Jul 10 00:58 /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/3423284/tmp/hooks/D01_modify_environment finished +I: user script /srv/workspace/pbuilder/3423284/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='trixie' - 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]="21" [3]="1" [4]="release" [5]="x86_64-pc-linux-gnu") + BASH_VERSION='5.2.21(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=trixie + EUID=0 + FUNCNAME=([0]="Echo" [1]="main") + GROUPS=() + HOME=/root + HOSTNAME=i-capture-the-hostname + HOSTTYPE=x86_64 + HOST_ARCH=amd64 IFS=' ' - INVOCATION_ID='6574b5e5de2f47fca20d9cf7d0631cac' - 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='2285845' - PS1='# ' - PS2='> ' + INVOCATION_ID=2f578a31a6c243698b923f907e288ff4 + 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=3423284 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.bfG4FdMG/pbuilderrc_hJ59 --distribution trixie --hookdir /etc/pbuilder/first-build-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/trixie-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.bfG4FdMG/b1 --logfile b1/build.log madness_0.10.1+git20200818.eee5fd9f-3.dsc' - SUDO_GID='111' - SUDO_UID='106' - SUDO_USER='jenkins' - TERM='unknown' - TZ='/usr/share/zoneinfo/Etc/GMT+12' - USER='root' - _='/usr/bin/systemd-run' - http_proxy='http://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.bfG4FdMG/pbuilderrc_mh6Q --distribution trixie --hookdir /etc/pbuilder/rebuild-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/trixie-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.bfG4FdMG/b2 --logfile b2/build.log madness_0.10.1+git20200818.eee5fd9f-3.dsc' + SUDO_GID=111 + SUDO_UID=106 + SUDO_USER=jenkins + TERM=unknown + TZ=/usr/share/zoneinfo/Etc/GMT-14 + UID=0 + USER=root + _='I: set' + http_proxy=http://213.165.73.152:3128 I: uname -a - Linux ionos11-amd64 6.1.0-21-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.1.90-1 (2024-05-03) x86_64 GNU/Linux + Linux i-capture-the-hostname 6.7.12+bpo-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.7.12-1~bpo12+1 (2024-05-06) x86_64 GNU/Linux I: ls -l /bin - lrwxrwxrwx 1 root root 7 Jun 4 11:25 /bin -> usr/bin -I: user script /srv/workspace/pbuilder/2285845/tmp/hooks/D02_print_environment finished + lrwxrwxrwx 1 root root 7 Jul 9 17:47 /bin -> usr/bin +I: user script /srv/workspace/pbuilder/3423284/tmp/hooks/D02_print_environment finished -> Attempting to satisfy build-dependencies -> Creating pbuilder-satisfydepends-dummy package Package: pbuilder-satisfydepends-dummy @@ -238,7 +270,7 @@ Get: 107 http://deb.debian.org/debian trixie/main amd64 pkgconf-bin amd64 1.8.1-1+b2 [29.7 kB] Get: 108 http://deb.debian.org/debian trixie/main amd64 pkgconf amd64 1.8.1-1+b2 [26.2 kB] Get: 109 http://deb.debian.org/debian trixie/main amd64 pkg-config amd64 1.8.1-1+b2 [14.0 kB] -Fetched 148 MB in 2s (70.6 MB/s) +Fetched 148 MB in 9s (15.6 MB/s) debconf: delaying package configuration, since apt-utils is not installed Selecting previously unselected package libpython3.11-minimal: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 ... 19698 files and directories currently installed.) @@ -603,8 +635,8 @@ Setting up tzdata (2024a-4) ... Current default time zone: 'Etc/UTC' -Local time is now: Thu Jun 6 17:33:29 UTC 2024. -Universal Time is now: Thu Jun 6 17:33:29 UTC 2024. +Local time is now: Thu Jul 10 00:59:35 UTC 2025. +Universal Time is now: Thu Jul 10 00:59:35 UTC 2025. Run 'dpkg-reconfigure tzdata' if you wish to change it. Setting up autotools-dev (20220109.1) ... @@ -710,7 +742,11 @@ Building tag database... -> Finished parsing the build-deps I: Building the package -I: Running cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/ && 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 > ../madness_0.10.1+git20200818.eee5fd9f-3_source.changes +I: user script /srv/workspace/pbuilder/3423284/tmp/hooks/A99_set_merged_usr starting +Not re-configuring usrmerge for trixie +I: user script /srv/workspace/pbuilder/3423284/tmp/hooks/A99_set_merged_usr finished +hostname: Name or service not known +I: Running cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/ && 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 > ../madness_0.10.1+git20200818.eee5fd9f-3_source.changes dpkg-buildpackage: info: source package madness dpkg-buildpackage: info: source version 0.10.1+git20200818.eee5fd9f-3 dpkg-buildpackage: info: source distribution unstable @@ -1033,8 +1069,8 @@ * PCM * CUDA --- Configuring done (8.8s) --- Generating done (0.5s) +-- Configuring done (15.2s) +-- Generating done (1.2s) CMake Warning: Manually-specified variables were not used by the project: @@ -1050,7 +1086,7 @@ -- Build files have been written to: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu make[1]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f' 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/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' /usr/bin/cmake -S/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f -B/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu --check-build-system CMakeFiles/Makefile.cmake 0 /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/CMakeFiles /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu//CMakeFiles/progress.marks @@ -1058,104 +1094,148 @@ make[2]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make -f src/madness/mra/CMakeFiles/MADmra-obj.dir/build.make src/madness/mra/CMakeFiles/MADmra-obj.dir/depend make -f src/madness/world/CMakeFiles/MADworld-obj.dir/build.make src/madness/world/CMakeFiles/MADworld-obj.dir/depend -make -f src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/build.make src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/depend -make -f src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/build.make src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/depend -make -f src/madness/misc/CMakeFiles/MADmisc-obj.dir/build.make src/madness/misc/CMakeFiles/MADmisc-obj.dir/depend -make -f src/madness/tensor/CMakeFiles/MADtensor-obj.dir/build.make src/madness/tensor/CMakeFiles/MADtensor-obj.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make -f src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/build.make src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/depend cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/CMakeFiles/MADmra-obj.dir/DependInfo.cmake "--color=" -make -f src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/build.make src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/depend -make -f src/madness/external/gtest/CMakeFiles/MADgtest.dir/build.make src/madness/external/gtest/CMakeFiles/MADgtest.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/DependInfo.cmake "--color=" +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/CMakeFiles/MADworld-obj.dir/DependInfo.cmake "--color=" +make -f src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/build.make src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/DependInfo.cmake "--color=" +make -f src/madness/misc/CMakeFiles/MADmisc-obj.dir/build.make src/madness/misc/CMakeFiles/MADmisc-obj.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/CMakeFiles/MADworld-obj.dir/DependInfo.cmake "--color=" +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make -f src/madness/tensor/CMakeFiles/MADtensor-obj.dir/build.make src/madness/tensor/CMakeFiles/MADtensor-obj.dir/depend cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc/CMakeFiles/MADmisc-obj.dir/DependInfo.cmake "--color=" -make -f src/madness/misc/CMakeFiles/mgit-madness.dir/build.make src/madness/misc/CMakeFiles/mgit-madness.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor/CMakeFiles/MADtensor-obj.dir/DependInfo.cmake "--color=" -make -f src/apps/chem/CMakeFiles/MADchem-obj.dir/build.make src/apps/chem/CMakeFiles/MADchem-obj.dir/depend +make -f src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/build.make src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/depend +make -f src/madness/external/gtest/CMakeFiles/MADgtest.dir/build.make src/madness/external/gtest/CMakeFiles/MADgtest.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/DependInfo.cmake "--color=" +make -f src/madness/misc/CMakeFiles/mgit-madness.dir/build.make src/madness/misc/CMakeFiles/mgit-madness.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/gtest /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/gtest /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/gtest/CMakeFiles/MADgtest.dir/DependInfo.cmake "--color=" +make -f src/apps/chem/CMakeFiles/MADchem-obj.dir/build.make src/apps/chem/CMakeFiles/MADchem-obj.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc/CMakeFiles/mgit-madness.dir/DependInfo.cmake "--color=" -make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem/CMakeFiles/MADchem-obj.dir/DependInfo.cmake "--color=" -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -make -f src/madness/tensor/CMakeFiles/MADtensor-obj.dir/build.make src/madness/tensor/CMakeFiles/MADtensor-obj.dir/build -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make -f src/madness/world/CMakeFiles/MADworld-obj.dir/build.make src/madness/world/CMakeFiles/MADworld-obj.dir/build make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem/CMakeFiles/MADchem-obj.dir/DependInfo.cmake "--color=" make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make -f src/madness/mra/CMakeFiles/MADmra-obj.dir/build.make src/madness/mra/CMakeFiles/MADmra-obj.dir/build -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make -f src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/build.make src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/build -make -f src/madness/misc/CMakeFiles/MADmisc-obj.dir/build.make src/madness/misc/CMakeFiles/MADmisc-obj.dir/build -make -f src/madness/world/CMakeFiles/MADworld-obj.dir/build.make src/madness/world/CMakeFiles/MADworld-obj.dir/build +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make -f src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/build.make src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/build -make -f src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/build.make src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/build make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -make -f src/madness/external/gtest/CMakeFiles/MADgtest.dir/build.make src/madness/external/gtest/CMakeFiles/MADgtest.dir/build -make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -make -f src/apps/chem/CMakeFiles/MADchem-obj.dir/build.make src/apps/chem/CMakeFiles/MADchem-obj.dir/build make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make -f src/madness/misc/CMakeFiles/MADmisc-obj.dir/build.make src/madness/misc/CMakeFiles/MADmisc-obj.dir/build +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make -f src/madness/tensor/CMakeFiles/MADtensor-obj.dir/build.make src/madness/tensor/CMakeFiles/MADtensor-obj.dir/build +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make -f src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/build.make src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/build +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +[ 0%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/madness_exception.cc.o +make -f src/madness/external/gtest/CMakeFiles/MADgtest.dir/build.make src/madness/external/gtest/CMakeFiles/MADgtest.dir/build +[ 0%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/world.cc.o +[ 3%] Building CXX object src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinystr.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/world.cc.o -MF CMakeFiles/MADworld-obj.dir/world.cc.o.d -o CMakeFiles/MADworld-obj.dir/world.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/world.cc make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make -f src/madness/misc/CMakeFiles/mgit-madness.dir/build.make src/madness/misc/CMakeFiles/mgit-madness.dir/build +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/madness_exception.cc.o -MF CMakeFiles/MADworld-obj.dir/madness_exception.cc.o.d -o CMakeFiles/MADworld-obj.dir/madness_exception.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/madness_exception.cc make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make -f src/apps/chem/CMakeFiles/MADchem-obj.dir/build.make src/apps/chem/CMakeFiles/MADchem-obj.dir/build +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinystr.cc.o -MF CMakeFiles/MADtinyxml-obj.dir/tinystr.cc.o.d -o CMakeFiles/MADtinyxml-obj.dir/tinystr.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml/tinystr.cc +[ 6%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/timers.cc.o +[ 6%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/info.cc.o +[ 6%] Building CXX object src/madness/tensor/CMakeFiles/MADtensor-obj.dir/tensor.cc.o make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -make -f src/madness/misc/CMakeFiles/mgit-madness.dir/build.make src/madness/misc/CMakeFiles/mgit-madness.dir/build -[ 3%] Building CXX object src/madness/tensor/CMakeFiles/MADtensor-obj.dir/tensoriter.cc.o -[ 3%] Building CXX object src/madness/tensor/CMakeFiles/MADtensor-obj.dir/basetensor.cc.o -[ 3%] Building CXX object src/madness/tensor/CMakeFiles/MADtensor-obj.dir/tensor.cc.o -[ 3%] Building CXX object src/madness/misc/CMakeFiles/MADmisc-obj.dir/position_stream.cc.o -[ 6%] Building CXX object src/madness/tensor/CMakeFiles/MADtensor-obj.dir/vmath.cc.o -[ 6%] Building CXX object src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinystr.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADtensor-obj.dir/tensoriter.cc.o -MF CMakeFiles/MADtensor-obj.dir/tensoriter.cc.o.d -o CMakeFiles/MADtensor-obj.dir/tensoriter.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/tensoriter.cc +[ 6%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/future.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/timers.cc.o -MF CMakeFiles/MADworld-obj.dir/timers.cc.o.d -o CMakeFiles/MADworld-obj.dir/timers.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/timers.cc +[ 6%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/redirectio.cc.o +[ 6%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/mra1.cc.o [ 6%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/mra2.cc.o -[ 9%] Building CXX object src/madness/external/gtest/CMakeFiles/MADgtest.dir/gtest-all.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/mra1.cc.o -MF CMakeFiles/MADmra-obj.dir/mra1.cc.o.d -o CMakeFiles/MADmra-obj.dir/mra1.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra1.cc +[ 6%] Building CXX object src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxml.cc.o +[ 6%] Building CXX object src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxmlerror.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADtensor-obj.dir/tensor.cc.o -MF CMakeFiles/MADtensor-obj.dir/tensor.cc.o.d -o CMakeFiles/MADtensor-obj.dir/tensor.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/tensor.cc -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/misc/CMakeFiles/MADmisc-obj.dir/position_stream.cc.o -MF CMakeFiles/MADmisc-obj.dir/position_stream.cc.o.d -o CMakeFiles/MADmisc-obj.dir/position_stream.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc/position_stream.cc -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADtensor-obj.dir/basetensor.cc.o -MF CMakeFiles/MADtensor-obj.dir/basetensor.cc.o.d -o CMakeFiles/MADtensor-obj.dir/basetensor.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/basetensor.cc -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinystr.cc.o -MF CMakeFiles/MADtinyxml-obj.dir/tinystr.cc.o.d -o CMakeFiles/MADtinyxml-obj.dir/tinystr.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml/tinystr.cc -make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 9%] Building CXX object src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxml.cc.o -[ 9%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/mra1.cc.o -[ 9%] Building CXX object src/madness/misc/CMakeFiles/MADmisc-obj.dir/checksum_file.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADtensor-obj.dir/vmath.cc.o -MF CMakeFiles/MADtensor-obj.dir/vmath.cc.o.d -o CMakeFiles/MADtensor-obj.dir/vmath.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/vmath.cc +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxmlerror.cc.o -MF CMakeFiles/MADtinyxml-obj.dir/tinyxmlerror.cc.o.d -o CMakeFiles/MADtinyxml-obj.dir/tinyxmlerror.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml/tinyxmlerror.cc +[ 6%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/debug.cc.o +[ 6%] Building CXX object src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserBytecode.cpp.o +[ 6%] Building CXX object src/madness/misc/CMakeFiles/MADmisc-obj.dir/checksum_file.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/mra2.cc.o -MF CMakeFiles/MADmra-obj.dir/mra2.cc.o.d -o CMakeFiles/MADmra-obj.dir/mra2.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra2.cc -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/gtest && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/gtest -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/gtest -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/gtest/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/gtest/CMakeFiles/MADgtest.dir/gtest-all.cc.o -MF CMakeFiles/MADgtest.dir/gtest-all.cc.o.d -o CMakeFiles/MADgtest.dir/gtest-all.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/gtest/gtest-all.cc -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/mra1.cc.o -MF CMakeFiles/MADmra-obj.dir/mra1.cc.o.d -o CMakeFiles/MADmra-obj.dir/mra1.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra1.cc -[ 12%] Building CXX object src/madness/misc/CMakeFiles/MADmisc-obj.dir/gprofexit.cc.o +[ 6%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/mra3.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/future.cc.o -MF CMakeFiles/MADworld-obj.dir/future.cc.o.d -o CMakeFiles/MADworld-obj.dir/future.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/future.cc +[ 6%] Building CXX object src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserBase.cpp.o +[ 9%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/mra4.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserBase.cpp.o -MF CMakeFiles/MADmuparser-obj.dir/muParserBase.cpp.o.d -o CMakeFiles/MADmuparser-obj.dir/muParserBase.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser/muParserBase.cpp +[ 12%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/archive_type_names.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/mra3.cc.o -MF CMakeFiles/MADmra-obj.dir/mra3.cc.o.d -o CMakeFiles/MADmra-obj.dir/mra3.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra3.cc +[ 15%] Building CXX object src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserCallback.cpp.o +[ 15%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/mra5.cc.o +[ 15%] Building CXX object src/madness/misc/CMakeFiles/MADmisc-obj.dir/ran.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/mra5.cc.o -MF CMakeFiles/MADmra-obj.dir/mra5.cc.o.d -o CMakeFiles/MADmra-obj.dir/mra5.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra5.cc cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxml.cc.o -MF CMakeFiles/MADtinyxml-obj.dir/tinyxml.cc.o.d -o CMakeFiles/MADtinyxml-obj.dir/tinyxml.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml/tinyxml.cc +[ 18%] Building CXX object src/madness/tensor/CMakeFiles/MADtensor-obj.dir/tensoriter.cc.o +[ 21%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/startup.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/redirectio.cc.o -MF CMakeFiles/MADworld-obj.dir/redirectio.cc.o.d -o CMakeFiles/MADworld-obj.dir/redirectio.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/redirectio.cc +[ 12%] Building CXX object src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserError.cpp.o +[ 6%] Building CXX object src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParser.cpp.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/info.cc.o -MF CMakeFiles/MADworld-obj.dir/info.cc.o.d -o CMakeFiles/MADworld-obj.dir/info.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/info.cc +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/debug.cc.o -MF CMakeFiles/MADworld-obj.dir/debug.cc.o.d -o CMakeFiles/MADworld-obj.dir/debug.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/debug.cc cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/misc/CMakeFiles/MADmisc-obj.dir/checksum_file.cc.o -MF CMakeFiles/MADmisc-obj.dir/checksum_file.cc.o.d -o CMakeFiles/MADmisc-obj.dir/checksum_file.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc/checksum_file.cc -[ 12%] Building CXX object src/madness/misc/CMakeFiles/MADmisc-obj.dir/ran.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserBytecode.cpp.o -MF CMakeFiles/MADmuparser-obj.dir/muParserBytecode.cpp.o.d -o CMakeFiles/MADmuparser-obj.dir/muParserBytecode.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser/muParserBytecode.cpp +[ 28%] Building CXX object src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/lapack.cc.o +[ 28%] Building CXX object src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxmlparser.cc.o +[ 31%] Building CXX object src/madness/misc/CMakeFiles/MADmisc-obj.dir/gprofexit.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/misc/CMakeFiles/MADmisc-obj.dir/gprofexit.cc.o -MF CMakeFiles/MADmisc-obj.dir/gprofexit.cc.o.d -o CMakeFiles/MADmisc-obj.dir/gprofexit.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc/gprofexit.cc -[ 12%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/madness_exception.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxmlparser.cc.o -MF CMakeFiles/MADtinyxml-obj.dir/tinyxmlparser.cc.o.d -o CMakeFiles/MADtinyxml-obj.dir/tinyxmlparser.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml/tinyxmlparser.cc +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/mra4.cc.o -MF CMakeFiles/MADmra-obj.dir/mra4.cc.o.d -o CMakeFiles/MADmra-obj.dir/mra4.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra4.cc +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADtensor-obj.dir/tensoriter.cc.o -MF CMakeFiles/MADtensor-obj.dir/tensoriter.cc.o.d -o CMakeFiles/MADtensor-obj.dir/tensoriter.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/tensoriter.cc +[ 31%] Building CXX object src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/solvers.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/solvers.cc.o -MF CMakeFiles/MADlinalg-obj.dir/solvers.cc.o.d -o CMakeFiles/MADlinalg-obj.dir/solvers.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/solvers.cc cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/misc/CMakeFiles/MADmisc-obj.dir/ran.cc.o -MF CMakeFiles/MADmisc-obj.dir/ran.cc.o.d -o CMakeFiles/MADmisc-obj.dir/ran.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc/ran.cc -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/madness_exception.cc.o -MF CMakeFiles/MADworld-obj.dir/madness_exception.cc.o.d -o CMakeFiles/MADworld-obj.dir/madness_exception.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/madness_exception.cc -[ 15%] Building CXX object src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/lapack.cc.o -[ 18%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/correlationfactor.cc.o +[ 31%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/mra6.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/mra6.cc.o -MF CMakeFiles/MADmra-obj.dir/mra6.cc.o.d -o CMakeFiles/MADmra-obj.dir/mra6.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra6.cc +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/archive_type_names.cc.o -MF CMakeFiles/MADworld-obj.dir/archive_type_names.cc.o.d -o CMakeFiles/MADworld-obj.dir/archive_type_names.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/archive_type_names.cc +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserCallback.cpp.o -MF CMakeFiles/MADmuparser-obj.dir/muParserCallback.cpp.o.d -o CMakeFiles/MADmuparser-obj.dir/muParserCallback.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser/muParserCallback.cpp +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/startup.cc.o -MF CMakeFiles/MADmra-obj.dir/startup.cc.o.d -o CMakeFiles/MADmra-obj.dir/startup.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/startup.cc cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/lapack.cc.o -MF CMakeFiles/MADlinalg-obj.dir/lapack.cc.o.d -o CMakeFiles/MADlinalg-obj.dir/lapack.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/lapack.cc -[ 18%] Building CXX object src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxmlerror.cc.o -[ 18%] Building CXX object src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserBytecode.cpp.o +[ 31%] Building CXX object src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/elem.cc.o +[ 31%] Building CXX object src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserTokenReader.cpp.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParser.cpp.o -MF CMakeFiles/MADmuparser-obj.dir/muParser.cpp.o.d -o CMakeFiles/MADmuparser-obj.dir/muParser.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser/muParser.cpp +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserError.cpp.o -MF CMakeFiles/MADmuparser-obj.dir/muParserError.cpp.o.d -o CMakeFiles/MADmuparser-obj.dir/muParserError.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser/muParserError.cpp +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/elem.cc.o -MF CMakeFiles/MADlinalg-obj.dir/elem.cc.o.d -o CMakeFiles/MADlinalg-obj.dir/elem.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/elem.cc +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserTokenReader.cpp.o -MF CMakeFiles/MADmuparser-obj.dir/muParserTokenReader.cpp.o.d -o CMakeFiles/MADmuparser-obj.dir/muParserTokenReader.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser/muParserTokenReader.cpp +[ 34%] Building CXX object src/madness/misc/CMakeFiles/MADmisc-obj.dir/cfft.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/misc/CMakeFiles/MADmisc-obj.dir/cfft.cc.o -MF CMakeFiles/MADmisc-obj.dir/cfft.cc.o.d -o CMakeFiles/MADmisc-obj.dir/cfft.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc/cfft.cc +[ 37%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/print.cc.o +[ 34%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/twoscale.cc.o +[ 37%] Building CXX object src/madness/external/gtest/CMakeFiles/MADgtest.dir/gtest-all.cc.o +[ 34%] Building CXX object src/madness/misc/CMakeFiles/MADmisc-obj.dir/position_stream.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/print.cc.o -MF CMakeFiles/MADworld-obj.dir/print.cc.o.d -o CMakeFiles/MADworld-obj.dir/print.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/print.cc +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/twoscale.cc.o -MF CMakeFiles/MADmra-obj.dir/twoscale.cc.o.d -o CMakeFiles/MADmra-obj.dir/twoscale.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/twoscale.cc +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/gtest && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/gtest -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/gtest -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/gtest/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/gtest/CMakeFiles/MADgtest.dir/gtest-all.cc.o -MF CMakeFiles/MADgtest.dir/gtest-all.cc.o.d -o CMakeFiles/MADgtest.dir/gtest-all.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/gtest/gtest-all.cc +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/misc/CMakeFiles/MADmisc-obj.dir/position_stream.cc.o -MF CMakeFiles/MADmisc-obj.dir/position_stream.cc.o.d -o CMakeFiles/MADmisc-obj.dir/position_stream.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc/position_stream.cc +[ 34%] Building CXX object src/madness/tensor/CMakeFiles/MADtensor-obj.dir/basetensor.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADtensor-obj.dir/basetensor.cc.o -MF CMakeFiles/MADtensor-obj.dir/basetensor.cc.o.d -o CMakeFiles/MADtensor-obj.dir/basetensor.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/basetensor.cc +[ 34%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/legendre.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/legendre.cc.o -MF CMakeFiles/MADmra-obj.dir/legendre.cc.o.d -o CMakeFiles/MADmra-obj.dir/legendre.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/legendre.cc +[ 40%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/correlationfactor.cc.o +[ 43%] generating the gitversion file cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/correlationfactor.cc.o -MF CMakeFiles/MADchem-obj.dir/correlationfactor.cc.o.d -o CMakeFiles/MADchem-obj.dir/correlationfactor.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/correlationfactor.cc -[ 18%] Building CXX object src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserBase.cpp.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxmlerror.cc.o -MF CMakeFiles/MADtinyxml-obj.dir/tinyxmlerror.cc.o.d -o CMakeFiles/MADtinyxml-obj.dir/tinyxmlerror.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml/tinyxmlerror.cc -[ 21%] generating the gitversion file -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserBase.cpp.o -MF CMakeFiles/MADmuparser-obj.dir/muParserBase.cpp.o.d -o CMakeFiles/MADmuparser-obj.dir/muParserBase.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser/muParserBase.cpp cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/cmake -Dlocal_dir="/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/cmake/" -Doutput_dir="/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc" -Dsource_dir="/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc" -P /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/cmake/git_version.cmake -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserBytecode.cpp.o -MF CMakeFiles/MADmuparser-obj.dir/muParserBytecode.cpp.o.d -o CMakeFiles/MADmuparser-obj.dir/muParserBytecode.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser/muParserBytecode.cpp CMake Deprecation Warning at /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/cmake/git_version.cmake:1 (cmake_minimum_required): Compatibility with CMake < 3.5 will be removed from a future version of CMake. @@ -1169,274 +1249,271 @@ -- GIT not found -- cannot find file /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc/gitversion.h -- creating file /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc/gitversion.h -[ 21%] Building CXX object src/madness/misc/CMakeFiles/MADmisc-obj.dir/cfft.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/misc/CMakeFiles/MADmisc-obj.dir/cfft.cc.o -MF CMakeFiles/MADmisc-obj.dir/cfft.cc.o.d -o CMakeFiles/MADmisc-obj.dir/cfft.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc/cfft.cc -[ 21%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/molecule.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/molecule.cc.o -MF CMakeFiles/MADchem-obj.dir/molecule.cc.o.d -o CMakeFiles/MADchem-obj.dir/molecule.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/molecule.cc -[ 25%] Building CXX object src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxmlparser.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxmlparser.cc.o -MF CMakeFiles/MADtinyxml-obj.dir/tinyxmlparser.cc.o.d -o CMakeFiles/MADtinyxml-obj.dir/tinyxmlparser.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml/tinyxmlparser.cc +[ 43%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/qmprop.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/qmprop.cc.o -MF CMakeFiles/MADmra-obj.dir/qmprop.cc.o.d -o CMakeFiles/MADmra-obj.dir/qmprop.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/qmprop.cc +[ 43%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldmem.cc.o make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 25%] Built target mgit-madness +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldmem.cc.o -MF CMakeFiles/MADworld-obj.dir/worldmem.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldmem.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldmem.cc +[ 43%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldrmi.cc.o +[ 43%] Built target mgit-madness +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldrmi.cc.o -MF CMakeFiles/MADworld-obj.dir/worldrmi.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldrmi.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldrmi.cc +[ 46%] Building CXX object src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/linalg_wrappers.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/linalg_wrappers.cc.o -MF CMakeFiles/MADlinalg-obj.dir/linalg_wrappers.cc.o.d -o CMakeFiles/MADlinalg-obj.dir/linalg_wrappers.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/linalg_wrappers.cc +[ 46%] Building CXX object src/madness/tensor/CMakeFiles/MADtensor-obj.dir/vmath.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADtensor-obj.dir/vmath.cc.o -MF CMakeFiles/MADtensor-obj.dir/vmath.cc.o.d -o CMakeFiles/MADtensor-obj.dir/vmath.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/vmath.cc +[ 46%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/safempi.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/safempi.cc.o -MF CMakeFiles/MADworld-obj.dir/safempi.cc.o.d -o CMakeFiles/MADworld-obj.dir/safempi.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/safempi.cc +/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/startup.cc:189:53: warning: macro "__TIME__" might prevent reproducible builds [-Wdate-time] + 189 | print(" compiled ...",__TIME__," on ",__DATE__); + | ^~~~~~~~ +/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/startup.cc:189:69: warning: macro "__DATE__" might prevent reproducible builds [-Wdate-time] + 189 | print(" compiled ...",__TIME__," on ",__DATE__); + | ^~~~~~~~ +[ 50%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldpapi.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldpapi.cc.o -MF CMakeFiles/MADworld-obj.dir/worldpapi.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldpapi.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldpapi.cc make -f src/madness/misc/CMakeFiles/MADgit-obj.dir/build.make src/madness/misc/CMakeFiles/MADgit-obj.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc/CMakeFiles/MADgit-obj.dir/DependInfo.cmake "--color=" +[ 50%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldref.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldref.cc.o -MF CMakeFiles/MADworld-obj.dir/worldref.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldref.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldref.cc +[ 50%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldam.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldam.cc.o -MF CMakeFiles/MADworld-obj.dir/worldam.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldam.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldam.cc make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make -f src/madness/misc/CMakeFiles/MADgit-obj.dir/build.make src/madness/misc/CMakeFiles/MADgit-obj.dir/build make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 25%] Building CXX object src/madness/misc/CMakeFiles/MADgit-obj.dir/gitinfo.cc.o +[ 50%] Building CXX object src/madness/misc/CMakeFiles/MADgit-obj.dir/gitinfo.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/misc/CMakeFiles/MADgit-obj.dir/gitinfo.cc.o -MF CMakeFiles/MADgit-obj.dir/gitinfo.cc.o.d -o CMakeFiles/MADgit-obj.dir/gitinfo.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc/gitinfo.cc +[ 53%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldprofile.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldprofile.cc.o -MF CMakeFiles/MADworld-obj.dir/worldprofile.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldprofile.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldprofile.cc /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc/gitinfo.cc:23:20: warning: macro "__TIME__" might prevent reproducible builds [-Wdate-time] 23 | return __TIME__; | ^~~~~~~~ /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc/gitinfo.cc:27:20: warning: macro "__DATE__" might prevent reproducible builds [-Wdate-time] 27 | return __DATE__; | ^~~~~~~~ -[ 25%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/mra3.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/mra3.cc.o -MF CMakeFiles/MADmra-obj.dir/mra3.cc.o.d -o CMakeFiles/MADmra-obj.dir/mra3.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra3.cc -[ 28%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/mra4.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/mra4.cc.o -MF CMakeFiles/MADmra-obj.dir/mra4.cc.o.d -o CMakeFiles/MADmra-obj.dir/mra4.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra4.cc -[ 28%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/world.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/world.cc.o -MF CMakeFiles/MADworld-obj.dir/world.cc.o.d -o CMakeFiles/MADworld-obj.dir/world.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/world.cc -[ 28%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/molecularbasis.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/molecularbasis.cc.o -MF CMakeFiles/MADchem-obj.dir/molecularbasis.cc.o.d -o CMakeFiles/MADchem-obj.dir/molecularbasis.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/molecularbasis.cc -[ 31%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/timers.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/timers.cc.o -MF CMakeFiles/MADworld-obj.dir/timers.cc.o.d -o CMakeFiles/MADworld-obj.dir/timers.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/timers.cc -[ 34%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/vibanal.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/vibanal.cc.o -MF CMakeFiles/MADchem-obj.dir/vibanal.cc.o.d -o CMakeFiles/MADchem-obj.dir/vibanal.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/vibanal.cc -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 34%] Built target MADtensor-obj -[ 34%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/future.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/future.cc.o -MF CMakeFiles/MADworld-obj.dir/future.cc.o.d -o CMakeFiles/MADworld-obj.dir/future.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/future.cc -[ 34%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/mra5.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/mra5.cc.o -MF CMakeFiles/MADmra-obj.dir/mra5.cc.o.d -o CMakeFiles/MADmra-obj.dir/mra5.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra5.cc -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 34%] Built target MADmisc-obj -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 34%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/mra6.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/mra6.cc.o -MF CMakeFiles/MADmra-obj.dir/mra6.cc.o.d -o CMakeFiles/MADmra-obj.dir/mra6.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra6.cc -[ 37%] Building CXX object src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserCallback.cpp.o -[ 37%] Built target MADgit-obj -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserCallback.cpp.o -MF CMakeFiles/MADmuparser-obj.dir/muParserCallback.cpp.o.d -o CMakeFiles/MADmuparser-obj.dir/muParserCallback.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser/muParserCallback.cpp -[ 37%] Building CXX object src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/solvers.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/solvers.cc.o -MF CMakeFiles/MADlinalg-obj.dir/solvers.cc.o.d -o CMakeFiles/MADlinalg-obj.dir/solvers.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/solvers.cc -[ 37%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/redirectio.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/redirectio.cc.o -MF CMakeFiles/MADworld-obj.dir/redirectio.cc.o.d -o CMakeFiles/MADworld-obj.dir/redirectio.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/redirectio.cc -[ 37%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/corepotential.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/corepotential.cc.o -MF CMakeFiles/MADchem-obj.dir/corepotential.cc.o.d -o CMakeFiles/MADchem-obj.dir/corepotential.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/corepotential.cc -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 37%] Built target MADtinyxml-obj -make -f src/madness/external/tinyxml/CMakeFiles/MADtinyxml.dir/build.make src/madness/external/tinyxml/CMakeFiles/MADtinyxml.dir/depend -make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml/CMakeFiles/MADtinyxml.dir/DependInfo.cmake "--color=" -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -make -f src/madness/external/tinyxml/CMakeFiles/MADtinyxml.dir/build.make src/madness/external/tinyxml/CMakeFiles/MADtinyxml.dir/build -make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 37%] Linking CXX static library libMADtinyxml.a -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml && /usr/bin/cmake -P CMakeFiles/MADtinyxml.dir/cmake_clean_target.cmake -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADtinyxml.dir/link.txt --verbose=1 -/usr/bin/ar qc libMADtinyxml.a "CMakeFiles/MADtinyxml-obj.dir/tinystr.cc.o" "CMakeFiles/MADtinyxml-obj.dir/tinyxml.cc.o" "CMakeFiles/MADtinyxml-obj.dir/tinyxmlerror.cc.o" "CMakeFiles/MADtinyxml-obj.dir/tinyxmlparser.cc.o" -[ 37%] Building CXX object src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParser.cpp.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParser.cpp.o -MF CMakeFiles/MADmuparser-obj.dir/muParser.cpp.o.d -o CMakeFiles/MADmuparser-obj.dir/muParser.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser/muParser.cpp -/usr/bin/ranlib libMADtinyxml.a -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 37%] Built target MADtinyxml -[ 37%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/atomutil.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/atomutil.cc.o -MF CMakeFiles/MADchem-obj.dir/atomutil.cc.o.d -o CMakeFiles/MADchem-obj.dir/atomutil.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/atomutil.cc -[ 37%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/lda.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/lda.cc.o -MF CMakeFiles/MADchem-obj.dir/lda.cc.o.d -o CMakeFiles/MADchem-obj.dir/lda.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/lda.cc -[ 40%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/archive_type_names.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/archive_type_names.cc.o -MF CMakeFiles/MADworld-obj.dir/archive_type_names.cc.o.d -o CMakeFiles/MADworld-obj.dir/archive_type_names.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/archive_type_names.cc -[ 43%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/distpm.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/distpm.cc.o -MF CMakeFiles/MADchem-obj.dir/distpm.cc.o.d -o CMakeFiles/MADchem-obj.dir/distpm.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/distpm.cc -[ 43%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/info.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/info.cc.o -MF CMakeFiles/MADworld-obj.dir/info.cc.o.d -o CMakeFiles/MADworld-obj.dir/info.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/info.cc -[ 43%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/debug.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/debug.cc.o -MF CMakeFiles/MADworld-obj.dir/debug.cc.o.d -o CMakeFiles/MADworld-obj.dir/debug.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/debug.cc -[ 46%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/print.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/print.cc.o -MF CMakeFiles/MADworld-obj.dir/print.cc.o.d -o CMakeFiles/MADworld-obj.dir/print.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/print.cc -[ 46%] Building CXX object src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserError.cpp.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserError.cpp.o -MF CMakeFiles/MADmuparser-obj.dir/muParserError.cpp.o.d -o CMakeFiles/MADmuparser-obj.dir/muParserError.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser/muParserError.cpp -[ 46%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldmem.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldmem.cc.o -MF CMakeFiles/MADworld-obj.dir/worldmem.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldmem.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldmem.cc -[ 46%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/SCF.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/SCF.cc.o -MF CMakeFiles/MADchem-obj.dir/SCF.cc.o.d -o CMakeFiles/MADchem-obj.dir/SCF.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/SCF.cc -[ 46%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldrmi.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldrmi.cc.o -MF CMakeFiles/MADworld-obj.dir/worldrmi.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldrmi.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldrmi.cc -[ 46%] Building CXX object src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserTokenReader.cpp.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/c++ -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserTokenReader.cpp.o -MF CMakeFiles/MADmuparser-obj.dir/muParserTokenReader.cpp.o.d -o CMakeFiles/MADmuparser-obj.dir/muParserTokenReader.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser/muParserTokenReader.cpp -[ 46%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/gth_pseudopotential.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/gth_pseudopotential.cc.o -MF CMakeFiles/MADchem-obj.dir/gth_pseudopotential.cc.o.d -o CMakeFiles/MADchem-obj.dir/gth_pseudopotential.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/gth_pseudopotential.cc -[ 46%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/safempi.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/safempi.cc.o -MF CMakeFiles/MADworld-obj.dir/safempi.cc.o.d -o CMakeFiles/MADworld-obj.dir/safempi.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/safempi.cc -[ 50%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldpapi.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldpapi.cc.o -MF CMakeFiles/MADworld-obj.dir/worldpapi.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldpapi.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldpapi.cc -[ 50%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldref.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldref.cc.o -MF CMakeFiles/MADworld-obj.dir/worldref.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldref.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldref.cc -[ 50%] Building CXX object src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/elem.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/elem.cc.o -MF CMakeFiles/MADlinalg-obj.dir/elem.cc.o.d -o CMakeFiles/MADlinalg-obj.dir/elem.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/elem.cc -[ 53%] Building CXX object src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/linalg_wrappers.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/tensor/CMakeFiles/MADlinalg-obj.dir/linalg_wrappers.cc.o -MF CMakeFiles/MADlinalg-obj.dir/linalg_wrappers.cc.o.d -o CMakeFiles/MADlinalg-obj.dir/linalg_wrappers.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/linalg_wrappers.cc -[ 53%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldam.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldam.cc.o -MF CMakeFiles/MADworld-obj.dir/worldam.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldam.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldam.cc -[ 56%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldprofile.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldprofile.cc.o -MF CMakeFiles/MADworld-obj.dir/worldprofile.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldprofile.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldprofile.cc -[ 56%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/thread.cc.o +[ 53%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/thread.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/thread.cc.o -MF CMakeFiles/MADworld-obj.dir/thread.cc.o.d -o CMakeFiles/MADworld-obj.dir/thread.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/thread.cc -[ 56%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/world_task_queue.cc.o +[ 53%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/world_task_queue.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/world_task_queue.cc.o -MF CMakeFiles/MADworld-obj.dir/world_task_queue.cc.o.d -o CMakeFiles/MADworld-obj.dir/world_task_queue.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/world_task_queue.cc -[ 59%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/nemo.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/nemo.cc.o -MF CMakeFiles/MADchem-obj.dir/nemo.cc.o.d -o CMakeFiles/MADchem-obj.dir/nemo.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/nemo.cc -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 59%] Built target MADmuparser-obj -make -f src/madness/external/muParser/CMakeFiles/MADmuparser.dir/build.make src/madness/external/muParser/CMakeFiles/MADmuparser.dir/depend -make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser/CMakeFiles/MADmuparser.dir/DependInfo.cmake "--color=" -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -make -f src/madness/external/muParser/CMakeFiles/MADmuparser.dir/build.make src/madness/external/muParser/CMakeFiles/MADmuparser.dir/build -make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 62%] Linking CXX static library libMADmuparser.a -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/cmake -P CMakeFiles/MADmuparser.dir/cmake_clean_target.cmake -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADmuparser.dir/link.txt --verbose=1 -/usr/bin/ar qc libMADmuparser.a "CMakeFiles/MADmuparser-obj.dir/muParserBase.cpp.o" "CMakeFiles/MADmuparser-obj.dir/muParserBytecode.cpp.o" "CMakeFiles/MADmuparser-obj.dir/muParserCallback.cpp.o" "CMakeFiles/MADmuparser-obj.dir/muParser.cpp.o" "CMakeFiles/MADmuparser-obj.dir/muParserError.cpp.o" "CMakeFiles/MADmuparser-obj.dir/muParserTokenReader.cpp.o" -[ 62%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/mp2.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/mp2.cc.o -MF CMakeFiles/MADchem-obj.dir/mp2.cc.o.d -o CMakeFiles/MADchem-obj.dir/mp2.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/mp2.cc -/usr/bin/ranlib libMADmuparser.a -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 62%] Built target MADmuparser -[ 62%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/pcm.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/pcm.cc.o -MF CMakeFiles/MADchem-obj.dir/pcm.cc.o.d -o CMakeFiles/MADchem-obj.dir/pcm.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/pcm.cc -[ 62%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldgop.cc.o +[ 53%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldgop.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldgop.cc.o -MF CMakeFiles/MADworld-obj.dir/worldgop.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldgop.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldgop.cc -[ 65%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/deferred_cleanup.cc.o +[ 53%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/molecule.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/molecule.cc.o -MF CMakeFiles/MADchem-obj.dir/molecule.cc.o.d -o CMakeFiles/MADchem-obj.dir/molecule.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/molecule.cc +[ 53%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/molecularbasis.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/molecularbasis.cc.o -MF CMakeFiles/MADchem-obj.dir/molecularbasis.cc.o.d -o CMakeFiles/MADchem-obj.dir/molecularbasis.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/molecularbasis.cc +[ 56%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/deferred_cleanup.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/deferred_cleanup.cc.o -MF CMakeFiles/MADworld-obj.dir/deferred_cleanup.cc.o.d -o CMakeFiles/MADworld-obj.dir/deferred_cleanup.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/deferred_cleanup.cc -[ 65%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldmutex.cc.o +[ 56%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldmutex.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldmutex.cc.o -MF CMakeFiles/MADworld-obj.dir/worldmutex.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldmutex.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldmutex.cc -[ 65%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/binary_fstream_archive.cc.o +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +[ 56%] Built target MADgit-obj +[ 59%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/vibanal.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/vibanal.cc.o -MF CMakeFiles/MADchem-obj.dir/vibanal.cc.o.d -o CMakeFiles/MADchem-obj.dir/vibanal.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/vibanal.cc +[ 59%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/corepotential.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/corepotential.cc.o -MF CMakeFiles/MADchem-obj.dir/corepotential.cc.o.d -o CMakeFiles/MADchem-obj.dir/corepotential.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/corepotential.cc +[ 59%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/binary_fstream_archive.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/binary_fstream_archive.cc.o -MF CMakeFiles/MADworld-obj.dir/binary_fstream_archive.cc.o.d -o CMakeFiles/MADworld-obj.dir/binary_fstream_archive.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/binary_fstream_archive.cc -[ 65%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/SCFOperators.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/SCFOperators.cc.o -MF CMakeFiles/MADchem-obj.dir/SCFOperators.cc.o.d -o CMakeFiles/MADchem-obj.dir/SCFOperators.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/SCFOperators.cc -[ 68%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/text_fstream_archive.cc.o +[ 59%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/atomutil.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/atomutil.cc.o -MF CMakeFiles/MADchem-obj.dir/atomutil.cc.o.d -o CMakeFiles/MADchem-obj.dir/atomutil.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/atomutil.cc +[ 59%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/lda.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/lda.cc.o -MF CMakeFiles/MADchem-obj.dir/lda.cc.o.d -o CMakeFiles/MADchem-obj.dir/lda.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/lda.cc +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +[ 62%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/distpm.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/distpm.cc.o -MF CMakeFiles/MADchem-obj.dir/distpm.cc.o.d -o CMakeFiles/MADchem-obj.dir/distpm.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/distpm.cc +[ 65%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/text_fstream_archive.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/text_fstream_archive.cc.o -MF CMakeFiles/MADworld-obj.dir/text_fstream_archive.cc.o.d -o CMakeFiles/MADworld-obj.dir/text_fstream_archive.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/text_fstream_archive.cc -[ 68%] Building C object src/madness/world/CMakeFiles/MADworld-obj.dir/lookup3.c.o +[ 65%] Built target MADtensor-obj +[ 65%] Building C object src/madness/world/CMakeFiles/MADworld-obj.dir/lookup3.c.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/cc -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -Werror=implicit-function-declaration -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/lookup3.c.o -MF CMakeFiles/MADworld-obj.dir/lookup3.c.o.d -o CMakeFiles/MADworld-obj.dir/lookup3.c.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/lookup3.c -[ 68%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldmpi.cc.o +[ 65%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/SCF.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/SCF.cc.o -MF CMakeFiles/MADchem-obj.dir/SCF.cc.o.d -o CMakeFiles/MADchem-obj.dir/SCF.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/SCF.cc +[ 65%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/worldmpi.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/worldmpi.cc.o -MF CMakeFiles/MADworld-obj.dir/worldmpi.cc.o.d -o CMakeFiles/MADworld-obj.dir/worldmpi.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldmpi.cc -[ 68%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/group.cc.o +[ 65%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/group.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/group.cc.o -MF CMakeFiles/MADworld-obj.dir/group.cc.o.d -o CMakeFiles/MADworld-obj.dir/group.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/group.cc -[ 71%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/parsec.cc.o +[ 68%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/parsec.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/parsec.cc.o -MF CMakeFiles/MADworld-obj.dir/parsec.cc.o.d -o CMakeFiles/MADworld-obj.dir/parsec.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parsec.cc +[ 68%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/gth_pseudopotential.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/gth_pseudopotential.cc.o -MF CMakeFiles/MADchem-obj.dir/gth_pseudopotential.cc.o.d -o CMakeFiles/MADchem-obj.dir/gth_pseudopotential.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/gth_pseudopotential.cc +[ 71%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/nemo.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/nemo.cc.o -MF CMakeFiles/MADchem-obj.dir/nemo.cc.o.d -o CMakeFiles/MADchem-obj.dir/nemo.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/nemo.cc +[ 71%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/mp2.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/mp2.cc.o -MF CMakeFiles/MADchem-obj.dir/mp2.cc.o.d -o CMakeFiles/MADchem-obj.dir/mp2.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/mp2.cc +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +[ 71%] Built target MADmisc-obj [ 71%] Building CXX object src/madness/world/CMakeFiles/MADworld-obj.dir/archive.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/world/CMakeFiles/MADworld-obj.dir/archive.cc.o -MF CMakeFiles/MADworld-obj.dir/archive.cc.o.d -o CMakeFiles/MADworld-obj.dir/archive.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/archive.cc +[ 71%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/pcm.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/pcm.cc.o -MF CMakeFiles/MADchem-obj.dir/pcm.cc.o.d -o CMakeFiles/MADchem-obj.dir/pcm.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/pcm.cc +[ 71%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/SCFOperators.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/SCFOperators.cc.o -MF CMakeFiles/MADchem-obj.dir/SCFOperators.cc.o.d -o CMakeFiles/MADchem-obj.dir/SCFOperators.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/SCFOperators.cc [ 75%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/TDHF.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/TDHF.cc.o -MF CMakeFiles/MADchem-obj.dir/TDHF.cc.o.d -o CMakeFiles/MADchem-obj.dir/TDHF.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/TDHF.cc [ 75%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/GuessFactory.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/GuessFactory.cc.o -MF CMakeFiles/MADchem-obj.dir/GuessFactory.cc.o.d -o CMakeFiles/MADchem-obj.dir/GuessFactory.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/GuessFactory.cc [ 75%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/CCStructures.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/CCStructures.cc.o -MF CMakeFiles/MADchem-obj.dir/CCStructures.cc.o.d -o CMakeFiles/MADchem-obj.dir/CCStructures.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/CCStructures.cc +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' [ 78%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/CC2.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/CC2.cc.o -MF CMakeFiles/MADchem-obj.dir/CC2.cc.o.d -o CMakeFiles/MADchem-obj.dir/CC2.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/CC2.cc +[ 78%] Built target MADtinyxml-obj +make -f src/madness/external/tinyxml/CMakeFiles/MADtinyxml.dir/build.make src/madness/external/tinyxml/CMakeFiles/MADtinyxml.dir/depend +make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml/CMakeFiles/MADtinyxml.dir/DependInfo.cmake "--color=" +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make -f src/madness/external/tinyxml/CMakeFiles/MADtinyxml.dir/build.make src/madness/external/tinyxml/CMakeFiles/MADtinyxml.dir/build +make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +[ 78%] Linking CXX static library libMADtinyxml.a +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml && /usr/bin/cmake -P CMakeFiles/MADtinyxml.dir/cmake_clean_target.cmake [ 78%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/CCPotentials.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/CCPotentials.cc.o -MF CMakeFiles/MADchem-obj.dir/CCPotentials.cc.o.d -o CMakeFiles/MADchem-obj.dir/CCPotentials.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/CCPotentials.cc +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADtinyxml.dir/link.txt --verbose=1 +/usr/bin/ar qc libMADtinyxml.a "CMakeFiles/MADtinyxml-obj.dir/tinystr.cc.o" "CMakeFiles/MADtinyxml-obj.dir/tinyxml.cc.o" "CMakeFiles/MADtinyxml-obj.dir/tinyxmlerror.cc.o" "CMakeFiles/MADtinyxml-obj.dir/tinyxmlparser.cc.o" +/usr/bin/ranlib libMADtinyxml.a +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +[ 78%] Built target MADtinyxml [ 78%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/AC.cc.o cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/AC.cc.o -MF CMakeFiles/MADchem-obj.dir/AC.cc.o.d -o CMakeFiles/MADchem-obj.dir/AC.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/AC.cc -[ 78%] Linking CXX static library libMADgtest.a -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/gtest && /usr/bin/cmake -P CMakeFiles/MADgtest.dir/cmake_clean_target.cmake -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/gtest && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADgtest.dir/link.txt --verbose=1 -/usr/bin/ar qc libMADgtest.a "CMakeFiles/MADgtest.dir/gtest-all.cc.o" -/usr/bin/ranlib libMADgtest.a -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 78%] Built target MADgtest -[ 81%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/startup.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/startup.cc.o -MF CMakeFiles/MADmra-obj.dir/startup.cc.o.d -o CMakeFiles/MADmra-obj.dir/startup.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/startup.cc +[ 78%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/pointgroupsymmetry.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/pointgroupsymmetry.cc.o -MF CMakeFiles/MADchem-obj.dir/pointgroupsymmetry.cc.o.d -o CMakeFiles/MADchem-obj.dir/pointgroupsymmetry.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/pointgroupsymmetry.cc +[ 81%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/znemo.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/znemo.cc.o -MF CMakeFiles/MADchem-obj.dir/znemo.cc.o.d -o CMakeFiles/MADchem-obj.dir/znemo.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/znemo.cc +[ 81%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/zcis.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/zcis.cc.o -MF CMakeFiles/MADchem-obj.dir/zcis.cc.o.d -o CMakeFiles/MADchem-obj.dir/zcis.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/zcis.cc +[ 81%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/diamagneticpotentialfactor.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/diamagneticpotentialfactor.cc.o -MF CMakeFiles/MADchem-obj.dir/diamagneticpotentialfactor.cc.o.d -o CMakeFiles/MADchem-obj.dir/diamagneticpotentialfactor.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/diamagneticpotentialfactor.cc +[ 84%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/oep.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/oep.cc.o -MF CMakeFiles/MADchem-obj.dir/oep.cc.o.d -o CMakeFiles/MADchem-obj.dir/oep.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/oep.cc +[ 84%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/PNO.cpp.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/PNO.cpp.o -MF CMakeFiles/MADchem-obj.dir/PNO.cpp.o.d -o CMakeFiles/MADchem-obj.dir/PNO.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNO.cpp +[ 84%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOF12Potentials.cpp.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOF12Potentials.cpp.o -MF CMakeFiles/MADchem-obj.dir/PNOF12Potentials.cpp.o.d -o CMakeFiles/MADchem-obj.dir/PNOF12Potentials.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOF12Potentials.cpp +[ 84%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOGuessFunctions.cpp.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOGuessFunctions.cpp.o -MF CMakeFiles/MADchem-obj.dir/PNOGuessFunctions.cpp.o.d -o CMakeFiles/MADchem-obj.dir/PNOGuessFunctions.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOGuessFunctions.cpp +[ 87%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOParameters.cpp.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOParameters.cpp.o -MF CMakeFiles/MADchem-obj.dir/PNOParameters.cpp.o.d -o CMakeFiles/MADchem-obj.dir/PNOParameters.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOParameters.cpp +[ 87%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOStructures.cpp.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOStructures.cpp.o -MF CMakeFiles/MADchem-obj.dir/PNOStructures.cpp.o.d -o CMakeFiles/MADchem-obj.dir/PNOStructures.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOStructures.cpp +[ 87%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/QCCalculationParametersBase.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/QCCalculationParametersBase.cc.o -MF CMakeFiles/MADchem-obj.dir/QCCalculationParametersBase.cc.o.d -o CMakeFiles/MADchem-obj.dir/QCCalculationParametersBase.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/QCCalculationParametersBase.cc +[ 90%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/MolecularOrbitals.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/MolecularOrbitals.cc.o -MF CMakeFiles/MADchem-obj.dir/MolecularOrbitals.cc.o.d -o CMakeFiles/MADchem-obj.dir/MolecularOrbitals.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/MolecularOrbitals.cc +[ 90%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/xcfunctional_libxc.cc.o +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/xcfunctional_libxc.cc.o -MF CMakeFiles/MADchem-obj.dir/xcfunctional_libxc.cc.o.d -o CMakeFiles/MADchem-obj.dir/xcfunctional_libxc.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/xcfunctional_libxc.cc make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 81%] Built target MADworld-obj +[ 90%] Built target MADworld-obj make -f src/madness/world/CMakeFiles/MADworld.dir/build.make src/madness/world/CMakeFiles/MADworld.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/CMakeFiles/MADworld.dir/DependInfo.cmake "--color=" make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make -f src/madness/world/CMakeFiles/MADworld.dir/build.make src/madness/world/CMakeFiles/MADworld.dir/build make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 81%] Linking CXX static library libMADworld.a +[ 90%] Linking CXX static library libMADworld.a cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/cmake -P CMakeFiles/MADworld.dir/cmake_clean_target.cmake -/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/startup.cc:189:53: warning: macro "__TIME__" might prevent reproducible builds [-Wdate-time] - 189 | print(" compiled ...",__TIME__," on ",__DATE__); - | ^~~~~~~~ -/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/startup.cc:189:69: warning: macro "__DATE__" might prevent reproducible builds [-Wdate-time] - 189 | print(" compiled ...",__TIME__," on ",__DATE__); - | ^~~~~~~~ cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADworld.dir/link.txt --verbose=1 /usr/bin/ar qc libMADworld.a "CMakeFiles/MADworld-obj.dir/madness_exception.cc.o" "CMakeFiles/MADworld-obj.dir/world.cc.o" "CMakeFiles/MADworld-obj.dir/timers.cc.o" "CMakeFiles/MADworld-obj.dir/future.cc.o" "CMakeFiles/MADworld-obj.dir/redirectio.cc.o" "CMakeFiles/MADworld-obj.dir/archive_type_names.cc.o" "CMakeFiles/MADworld-obj.dir/info.cc.o" "CMakeFiles/MADworld-obj.dir/debug.cc.o" "CMakeFiles/MADworld-obj.dir/print.cc.o" "CMakeFiles/MADworld-obj.dir/worldmem.cc.o" "CMakeFiles/MADworld-obj.dir/worldrmi.cc.o" "CMakeFiles/MADworld-obj.dir/safempi.cc.o" "CMakeFiles/MADworld-obj.dir/worldpapi.cc.o" "CMakeFiles/MADworld-obj.dir/worldref.cc.o" "CMakeFiles/MADworld-obj.dir/worldam.cc.o" "CMakeFiles/MADworld-obj.dir/worldprofile.cc.o" "CMakeFiles/MADworld-obj.dir/thread.cc.o" "CMakeFiles/MADworld-obj.dir/world_task_queue.cc.o" "CMakeFiles/MADworld-obj.dir/worldgop.cc.o" "CMakeFiles/MADworld-obj.dir/deferred_cleanup.cc.o" "CMakeFiles/MADworld-obj.dir/worldmutex.cc.o" "CMakeFiles/MADworld-obj.dir/binary_fstream_archive.cc.o" "CMakeFiles/MADworld-obj.dir/text_fstream_archive.cc.o" "CMakeFiles/MADworld-obj.dir/lookup3.c.o" "CMakeFiles/MADworld-obj.dir/worldmpi.cc.o" "CMakeFiles/MADworld-obj.dir/group.cc.o" "CMakeFiles/MADworld-obj.dir/parsec.cc.o" "CMakeFiles/MADworld-obj.dir/archive.cc.o" +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +[ 90%] Built target MADmuparser-obj +make -f src/madness/external/muParser/CMakeFiles/MADmuparser.dir/build.make src/madness/external/muParser/CMakeFiles/MADmuparser.dir/depend +make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser/CMakeFiles/MADmuparser.dir/DependInfo.cmake "--color=" /usr/bin/ranlib libMADworld.a make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 81%] Built target MADworld +make -f src/madness/external/muParser/CMakeFiles/MADmuparser.dir/build.make src/madness/external/muParser/CMakeFiles/MADmuparser.dir/build +make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +[ 93%] Linking CXX static library libMADmuparser.a +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/cmake -P CMakeFiles/MADmuparser.dir/cmake_clean_target.cmake +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADmuparser.dir/link.txt --verbose=1 +/usr/bin/ar qc libMADmuparser.a "CMakeFiles/MADmuparser-obj.dir/muParserBase.cpp.o" "CMakeFiles/MADmuparser-obj.dir/muParserBytecode.cpp.o" "CMakeFiles/MADmuparser-obj.dir/muParserCallback.cpp.o" "CMakeFiles/MADmuparser-obj.dir/muParser.cpp.o" "CMakeFiles/MADmuparser-obj.dir/muParserError.cpp.o" "CMakeFiles/MADmuparser-obj.dir/muParserTokenReader.cpp.o" +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +/usr/bin/ranlib libMADmuparser.a +[ 93%] Built target MADworld make -f src/madness/misc/CMakeFiles/MADmisc.dir/build.make src/madness/misc/CMakeFiles/MADmisc.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc/CMakeFiles/MADmisc.dir/DependInfo.cmake "--color=" make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make -f src/madness/misc/CMakeFiles/MADmisc.dir/build.make src/madness/misc/CMakeFiles/MADmisc.dir/build make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 81%] Linking CXX static library libMADmisc.a +[ 93%] Linking CXX static library libMADmisc.a cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/cmake -P CMakeFiles/MADmisc.dir/cmake_clean_target.cmake -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADmisc.dir/link.txt --verbose=1 -/usr/bin/ar qc libMADmisc.a "CMakeFiles/MADmisc-obj.dir/checksum_file.cc.o" "CMakeFiles/MADmisc-obj.dir/position_stream.cc.o" "CMakeFiles/MADmisc-obj.dir/gprofexit.cc.o" "CMakeFiles/MADmisc-obj.dir/ran.cc.o" "CMakeFiles/MADmisc-obj.dir/cfft.cc.o" -/usr/bin/ranlib libMADmisc.a make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 81%] Built target MADmisc +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADmisc.dir/link.txt --verbose=1 +[ 93%] Built target MADmuparser make -f src/madness/misc/CMakeFiles/MADgit.dir/build.make src/madness/misc/CMakeFiles/MADgit.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc/CMakeFiles/MADgit.dir/DependInfo.cmake "--color=" +/usr/bin/ar qc libMADmisc.a "CMakeFiles/MADmisc-obj.dir/checksum_file.cc.o" "CMakeFiles/MADmisc-obj.dir/position_stream.cc.o" "CMakeFiles/MADmisc-obj.dir/gprofexit.cc.o" "CMakeFiles/MADmisc-obj.dir/ran.cc.o" "CMakeFiles/MADmisc-obj.dir/cfft.cc.o" +/usr/bin/ranlib libMADmisc.a make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make -f src/madness/misc/CMakeFiles/MADgit.dir/build.make src/madness/misc/CMakeFiles/MADgit.dir/build make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 81%] Linking CXX static library libMADgit.a -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/cmake -P CMakeFiles/MADgit.dir/cmake_clean_target.cmake -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADgit.dir/link.txt --verbose=1 -/usr/bin/ar qc libMADgit.a "CMakeFiles/MADgit-obj.dir/gitinfo.cc.o" -/usr/bin/ranlib libMADgit.a make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 81%] Built target MADgit +[ 93%] Built target MADmisc make -f src/madness/tensor/CMakeFiles/MADtensor.dir/build.make src/madness/tensor/CMakeFiles/MADtensor.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +[ 93%] Linking CXX static library libMADgit.a cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor/CMakeFiles/MADtensor.dir/DependInfo.cmake "--color=" +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/cmake -P CMakeFiles/MADgit.dir/cmake_clean_target.cmake make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make -f src/madness/tensor/CMakeFiles/MADtensor.dir/build.make src/madness/tensor/CMakeFiles/MADtensor.dir/build make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 84%] Linking CXX static library libMADtensor.a +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADgit.dir/link.txt --verbose=1 +[ 96%] Linking CXX static library libMADtensor.a cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/cmake -P CMakeFiles/MADtensor.dir/cmake_clean_target.cmake +/usr/bin/ar qc libMADgit.a "CMakeFiles/MADgit-obj.dir/gitinfo.cc.o" cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADtensor.dir/link.txt --verbose=1 +/usr/bin/ranlib libMADgit.a +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' /usr/bin/ar qc libMADtensor.a "CMakeFiles/MADtensor-obj.dir/tensor.cc.o" "CMakeFiles/MADtensor-obj.dir/tensoriter.cc.o" "CMakeFiles/MADtensor-obj.dir/basetensor.cc.o" "CMakeFiles/MADtensor-obj.dir/vmath.cc.o" +[ 96%] Built target MADgit /usr/bin/ranlib libMADtensor.a make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 84%] Built target MADtensor -[ 84%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/legendre.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/legendre.cc.o -MF CMakeFiles/MADmra-obj.dir/legendre.cc.o.d -o CMakeFiles/MADmra-obj.dir/legendre.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/legendre.cc +[ 96%] Built target MADtensor +[ 96%] Linking CXX static library libMADgtest.a +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/gtest && /usr/bin/cmake -P CMakeFiles/MADgtest.dir/cmake_clean_target.cmake +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/gtest && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADgtest.dir/link.txt --verbose=1 +/usr/bin/ar qc libMADgtest.a "CMakeFiles/MADgtest.dir/gtest-all.cc.o" +/usr/bin/ranlib libMADgtest.a +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +[ 96%] Built target MADgtest make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 84%] Built target MADlinalg-obj +[ 96%] Built target MADlinalg-obj make -f src/madness/tensor/CMakeFiles/MADlinalg.dir/build.make src/madness/tensor/CMakeFiles/MADlinalg.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor/CMakeFiles/MADlinalg.dir/DependInfo.cmake "--color=" make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' make -f src/madness/tensor/CMakeFiles/MADlinalg.dir/build.make src/madness/tensor/CMakeFiles/MADlinalg.dir/build make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 84%] Linking CXX static library libMADlinalg.a +[ 96%] Linking CXX static library libMADlinalg.a cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/cmake -P CMakeFiles/MADlinalg.dir/cmake_clean_target.cmake cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADlinalg.dir/link.txt --verbose=1 /usr/bin/ar qc libMADlinalg.a "CMakeFiles/MADlinalg-obj.dir/lapack.cc.o" "CMakeFiles/MADlinalg-obj.dir/solvers.cc.o" "CMakeFiles/MADlinalg-obj.dir/elem.cc.o" "CMakeFiles/MADlinalg-obj.dir/linalg_wrappers.cc.o" /usr/bin/ranlib libMADlinalg.a make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 84%] Built target MADlinalg -[ 84%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/twoscale.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/twoscale.cc.o -MF CMakeFiles/MADmra-obj.dir/twoscale.cc.o.d -o CMakeFiles/MADmra-obj.dir/twoscale.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/twoscale.cc -[ 84%] Building CXX object src/madness/mra/CMakeFiles/MADmra-obj.dir/qmprop.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_DATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/madness/mra/CMakeFiles/MADmra-obj.dir/qmprop.cc.o -MF CMakeFiles/MADmra-obj.dir/qmprop.cc.o.d -o CMakeFiles/MADmra-obj.dir/qmprop.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/qmprop.cc -[ 84%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/pointgroupsymmetry.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/pointgroupsymmetry.cc.o -MF CMakeFiles/MADchem-obj.dir/pointgroupsymmetry.cc.o.d -o CMakeFiles/MADchem-obj.dir/pointgroupsymmetry.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/pointgroupsymmetry.cc -[ 87%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/znemo.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/znemo.cc.o -MF CMakeFiles/MADchem-obj.dir/znemo.cc.o.d -o CMakeFiles/MADchem-obj.dir/znemo.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/znemo.cc -[ 87%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/zcis.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/zcis.cc.o -MF CMakeFiles/MADchem-obj.dir/zcis.cc.o.d -o CMakeFiles/MADchem-obj.dir/zcis.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/zcis.cc -[ 87%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/diamagneticpotentialfactor.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/diamagneticpotentialfactor.cc.o -MF CMakeFiles/MADchem-obj.dir/diamagneticpotentialfactor.cc.o.d -o CMakeFiles/MADchem-obj.dir/diamagneticpotentialfactor.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/diamagneticpotentialfactor.cc +[ 96%] Built target MADlinalg +In file included from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/MolecularOrbitals.h:13, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/MolecularOrbitals.cc:8: +/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h: In member function 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]': +/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:33: warning: '.' directive writing 1 byte into a region of size between 0 and 255 [-Wformat-overflow=] + 158 | sprintf(buf, "%s.%5.5d", filename, world.rank()); + | ^ +In file included from /usr/include/stdio.h:964, + from /usr/include/c++/13/cstdio:42, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldmutex.h:38, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/dqueue.h:46, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/thread.h:41, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc/ran.h:36, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/tensor.h:36, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/MolecularOrbitals.h:12: +In function 'int sprintf(char*, const char*, ...)', + inlined from 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]' at /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:24: +/usr/include/x86_64-linux-gnu/bits/stdio2.h:30:34: note: '__builtin___sprintf_chk' output between 8 and 269 bytes into a destination of size 256 + 30 | return __builtin___sprintf_chk (__s, __USE_FORTIFY_LEVEL - 1, + | ~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ + 31 | __glibc_objsize (__s), __fmt, + | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ + 32 | __va_arg_pack ()); + | ~~~~~~~~~~~~~~~~~ In file included from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worlddc.h:46, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/MADworld.h:47, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra.h:44, @@ -1480,14 +1557,12 @@ | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 32 | __va_arg_pack ()); | ~~~~~~~~~~~~~~~~~ -[ 90%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/oep.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/oep.cc.o -MF CMakeFiles/MADchem-obj.dir/oep.cc.o.d -o CMakeFiles/MADchem-obj.dir/oep.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/oep.cc In file included from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worlddc.h:46, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/MADworld.h:47, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra.h:44, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/CCStructures.h:13, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/TDHF.h:11, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/TDHF.cc:8: + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/nemo.h:47, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/oep.h:13, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/oep.cc:8: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h: In member function 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]': /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:33: warning: '.' directive writing 1 byte into a region of size between 0 and 255 [-Wformat-overflow=] 158 | sprintf(buf, "%s.%5.5d", filename, world.rank()); @@ -1529,8 +1604,9 @@ In file included from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worlddc.h:46, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/MADworld.h:47, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra.h:44, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/SCF.h:47, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/SCF.cc:40: + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness.h:41, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/GuessFactory.h:13, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/zcis.cc:8: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h: In member function 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]': /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:33: warning: '.' directive writing 1 byte into a region of size between 0 and 255 [-Wformat-overflow=] 158 | sprintf(buf, "%s.%5.5d", filename, world.rank()); @@ -1569,12 +1645,25 @@ | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 32 | __va_arg_pack ()); | ~~~~~~~~~~~~~~~~~ +/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h: In member function 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamInputArchive]': +/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:33: warning: '.' directive writing 1 byte into a region of size between 0 and 255 [-Wformat-overflow=] + 158 | sprintf(buf, "%s.%5.5d", filename, world.rank()); + | ^ +In function 'int sprintf(char*, const char*, ...)', + inlined from 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamInputArchive]' at /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:24: +/usr/include/x86_64-linux-gnu/bits/stdio2.h:30:34: note: '__builtin___sprintf_chk' output between 8 and 269 bytes into a destination of size 256 + 30 | return __builtin___sprintf_chk (__s, __USE_FORTIFY_LEVEL - 1, + | ~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ + 31 | __glibc_objsize (__s), __fmt, + | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ + 32 | __va_arg_pack ()); + | ~~~~~~~~~~~~~~~~~ In file included from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worlddc.h:46, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/MADworld.h:47, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra.h:44, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/projector.h:11, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/CC2.h:11, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/CC2.cc:8: + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/CCStructures.h:13, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/TDHF.h:11, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/TDHF.cc:8: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h: In member function 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]': /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:33: warning: '.' directive writing 1 byte into a region of size between 0 and 255 [-Wformat-overflow=] 158 | sprintf(buf, "%s.%5.5d", filename, world.rank()); @@ -1616,8 +1705,9 @@ In file included from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worlddc.h:46, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/MADworld.h:47, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra.h:44, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/mp2.h:43, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/mp2.cc:45: + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/projector.h:11, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/CC2.h:11, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/CC2.cc:8: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h: In member function 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]': /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:33: warning: '.' directive writing 1 byte into a region of size between 0 and 255 [-Wformat-overflow=] 158 | sprintf(buf, "%s.%5.5d", filename, world.rank()); @@ -1660,24 +1750,16 @@ from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/MADworld.h:47, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra.h:44, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness.h:41, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/GuessFactory.h:13, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/zcis.cc:8: + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOGuessFunctions.h:19, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOF12Potentials.h:11, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNO.h:15, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNO.cpp:8: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h: In member function 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]': /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:33: warning: '.' directive writing 1 byte into a region of size between 0 and 255 [-Wformat-overflow=] 158 | sprintf(buf, "%s.%5.5d", filename, world.rank()); | ^ In file included from /usr/include/stdio.h:964, - from /usr/include/c++/13/cstdio:42, - from /usr/include/c++/13/ext/string_conversions.h:45, - from /usr/include/c++/13/bits/basic_string.h:4109, - from /usr/include/c++/13/string:54, - from /usr/include/c++/13/bits/locale_classes.h:40, - from /usr/include/c++/13/bits/ios_base.h:41, - from /usr/include/c++/13/ios:44, - from /usr/include/c++/13/ostream:40, - from /usr/include/c++/13/iostream:41, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/world.h:58, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/MADworld.h:42: + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOGuessFunctions.h:18: In function 'int sprintf(char*, const char*, ...)', inlined from 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]' at /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:24: /usr/include/x86_64-linux-gnu/bits/stdio2.h:30:34: note: '__builtin___sprintf_chk' output between 8 and 269 bytes into a destination of size 256 @@ -1700,12 +1782,11 @@ | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 32 | __va_arg_pack ()); | ~~~~~~~~~~~~~~~~~ -[ 90%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/PNO.cpp.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/PNO.cpp.o -MF CMakeFiles/MADchem-obj.dir/PNO.cpp.o.d -o CMakeFiles/MADchem-obj.dir/PNO.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNO.cpp In file included from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worlddc.h:46, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/MADworld.h:47, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra.h:44, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/znemo.cc:8: + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/SCF.h:47, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/SCF.cc:40: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h: In member function 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]': /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:33: warning: '.' directive writing 1 byte into a region of size between 0 and 255 [-Wformat-overflow=] 158 | sprintf(buf, "%s.%5.5d", filename, world.rank()); @@ -1747,9 +1828,7 @@ In file included from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worlddc.h:46, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/MADworld.h:47, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra.h:44, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/nemo.h:47, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/oep.h:13, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/oep.cc:8: + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/znemo.cc:8: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h: In member function 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]': /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:33: warning: '.' directive writing 1 byte into a region of size between 0 and 255 [-Wformat-overflow=] 158 | sprintf(buf, "%s.%5.5d", filename, world.rank()); @@ -1788,70 +1867,27 @@ | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 32 | __va_arg_pack ()); | ~~~~~~~~~~~~~~~~~ -[ 90%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOF12Potentials.cpp.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOF12Potentials.cpp.o -MF CMakeFiles/MADchem-obj.dir/PNOF12Potentials.cpp.o.d -o CMakeFiles/MADchem-obj.dir/PNOF12Potentials.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOF12Potentials.cpp -[ 90%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOGuessFunctions.cpp.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOGuessFunctions.cpp.o -MF CMakeFiles/MADchem-obj.dir/PNOGuessFunctions.cpp.o.d -o CMakeFiles/MADchem-obj.dir/PNOGuessFunctions.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOGuessFunctions.cpp -[ 93%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOParameters.cpp.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOParameters.cpp.o -MF CMakeFiles/MADchem-obj.dir/PNOParameters.cpp.o.d -o CMakeFiles/MADchem-obj.dir/PNOParameters.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOParameters.cpp In file included from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worlddc.h:46, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/MADworld.h:47, from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra/mra.h:44, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness.h:41, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOGuessFunctions.h:19, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOF12Potentials.h:11, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNO.h:15, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNO.cpp:8: -/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h: In member function 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]': -/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:33: warning: '.' directive writing 1 byte into a region of size between 0 and 255 [-Wformat-overflow=] - 158 | sprintf(buf, "%s.%5.5d", filename, world.rank()); - | ^ -In file included from /usr/include/stdio.h:964, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOGuessFunctions.h:18: -In function 'int sprintf(char*, const char*, ...)', - inlined from 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]' at /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:24: -/usr/include/x86_64-linux-gnu/bits/stdio2.h:30:34: note: '__builtin___sprintf_chk' output between 8 and 269 bytes into a destination of size 256 - 30 | return __builtin___sprintf_chk (__s, __USE_FORTIFY_LEVEL - 1, - | ~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ - 31 | __glibc_objsize (__s), __fmt, - | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ - 32 | __va_arg_pack ()); - | ~~~~~~~~~~~~~~~~~ -/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h: In member function 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamInputArchive]': -/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:33: warning: '.' directive writing 1 byte into a region of size between 0 and 255 [-Wformat-overflow=] - 158 | sprintf(buf, "%s.%5.5d", filename, world.rank()); - | ^ -In function 'int sprintf(char*, const char*, ...)', - inlined from 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamInputArchive]' at /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:24: -/usr/include/x86_64-linux-gnu/bits/stdio2.h:30:34: note: '__builtin___sprintf_chk' output between 8 and 269 bytes into a destination of size 256 - 30 | return __builtin___sprintf_chk (__s, __USE_FORTIFY_LEVEL - 1, - | ~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ - 31 | __glibc_objsize (__s), __fmt, - | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ - 32 | __va_arg_pack ()); - | ~~~~~~~~~~~~~~~~~ -[ 93%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOStructures.cpp.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/PNOStructures.cpp.o -MF CMakeFiles/MADchem-obj.dir/PNOStructures.cpp.o.d -o CMakeFiles/MADchem-obj.dir/PNOStructures.cpp.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/PNOStructures.cpp -[ 93%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/QCCalculationParametersBase.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/QCCalculationParametersBase.cc.o -MF CMakeFiles/MADchem-obj.dir/QCCalculationParametersBase.cc.o.d -o CMakeFiles/MADchem-obj.dir/QCCalculationParametersBase.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/QCCalculationParametersBase.cc -[ 96%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/MolecularOrbitals.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/MolecularOrbitals.cc.o -MF CMakeFiles/MADchem-obj.dir/MolecularOrbitals.cc.o.d -o CMakeFiles/MADchem-obj.dir/MolecularOrbitals.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/MolecularOrbitals.cc -[ 96%] Building CXX object src/apps/chem/CMakeFiles/MADchem-obj.dir/xcfunctional_libxc.cc.o -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem && /usr/bin/c++ -DMADNESS_MPI_HEADER=\"/usr/lib/x86_64-linux-gnu/mpich/include/mpi.h\" -DMAD_ROOT_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f\" -DMPICH_SKIP_MPICXX=1 -DMRA_CHEMDATA_DIR=\"/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem\" -DOMPI_SKIP_MPICXX=1 -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps -I/usr/lib/x86_64-linux-gnu/mpich/include -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/tinyxml -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/external/muParser -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra -I/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 -std=c++17 -fPIC -MD -MT src/apps/chem/CMakeFiles/MADchem-obj.dir/xcfunctional_libxc.cc.o -MF CMakeFiles/MADchem-obj.dir/xcfunctional_libxc.cc.o.d -o CMakeFiles/MADchem-obj.dir/xcfunctional_libxc.cc.o -c /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/xcfunctional_libxc.cc -In file included from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/MolecularOrbitals.h:13, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/MolecularOrbitals.cc:8: + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/mp2.h:43, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/mp2.cc:45: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h: In member function 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]': /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:33: warning: '.' directive writing 1 byte into a region of size between 0 and 255 [-Wformat-overflow=] 158 | sprintf(buf, "%s.%5.5d", filename, world.rank()); | ^ In file included from /usr/include/stdio.h:964, from /usr/include/c++/13/cstdio:42, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/worldmutex.h:38, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/dqueue.h:46, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/thread.h:41, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/misc/ran.h:36, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/tensor/tensor.h:36, - from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/apps/chem/MolecularOrbitals.h:12: + from /usr/include/c++/13/ext/string_conversions.h:45, + from /usr/include/c++/13/bits/basic_string.h:4109, + from /usr/include/c++/13/string:54, + from /usr/include/c++/13/bits/locale_classes.h:40, + from /usr/include/c++/13/bits/ios_base.h:41, + from /usr/include/c++/13/ios:44, + from /usr/include/c++/13/ostream:40, + from /usr/include/c++/13/iostream:41, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/world.h:58, + from /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/MADworld.h:42: In function 'int sprintf(char*, const char*, ...)', inlined from 'void madness::archive::BaseParallelArchive::open(madness::World&, const char*, int) [with Archive = madness::archive::BinaryFstreamOutputArchive]' at /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/world/parallel_archive.h:158:24: /usr/include/x86_64-linux-gnu/bits/stdio2.h:30:34: note: '__builtin___sprintf_chk' output between 8 and 269 bytes into a destination of size 256 @@ -1879,30 +1915,30 @@ make -f src/madness/CMakeFiles/madness.dir/build.make src/madness/CMakeFiles/madness.dir/depend make -f src/madness/mra/CMakeFiles/MADmra.dir/build.make src/madness/mra/CMakeFiles/MADmra.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/CMakeFiles/madness.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/CMakeFiles/madness.dir/DependInfo.cmake "--color=" cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/src/madness/mra /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/CMakeFiles/MADmra.dir/DependInfo.cmake "--color=" make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -make -f src/madness/CMakeFiles/madness.dir/build.make src/madness/CMakeFiles/madness.dir/build +make -f src/madness/mra/CMakeFiles/MADmra.dir/build.make src/madness/mra/CMakeFiles/MADmra.dir/build make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +make -f src/madness/CMakeFiles/madness.dir/build.make src/madness/CMakeFiles/madness.dir/build make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -make -f src/madness/mra/CMakeFiles/MADmra.dir/build.make src/madness/mra/CMakeFiles/MADmra.dir/build make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[ 96%] Linking CXX static library libmadness.a -cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness && /usr/bin/cmake -P CMakeFiles/madness.dir/cmake_clean_target.cmake [100%] Linking CXX static library libMADmra.a cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/cmake -P CMakeFiles/MADmra.dir/cmake_clean_target.cmake +[100%] Linking CXX static library libmadness.a +cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness && /usr/bin/cmake -P CMakeFiles/madness.dir/cmake_clean_target.cmake cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness && /usr/bin/cmake -E cmake_link_script CMakeFiles/madness.dir/link.txt --verbose=1 -/usr/bin/ar qc libmadness.a "world/CMakeFiles/MADworld-obj.dir/madness_exception.cc.o" "world/CMakeFiles/MADworld-obj.dir/world.cc.o" "world/CMakeFiles/MADworld-obj.dir/timers.cc.o" "world/CMakeFiles/MADworld-obj.dir/future.cc.o" "world/CMakeFiles/MADworld-obj.dir/redirectio.cc.o" "world/CMakeFiles/MADworld-obj.dir/archive_type_names.cc.o" "world/CMakeFiles/MADworld-obj.dir/info.cc.o" "world/CMakeFiles/MADworld-obj.dir/debug.cc.o" "world/CMakeFiles/MADworld-obj.dir/print.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldmem.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldrmi.cc.o" "world/CMakeFiles/MADworld-obj.dir/safempi.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldpapi.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldref.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldam.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldprofile.cc.o" "world/CMakeFiles/MADworld-obj.dir/thread.cc.o" "world/CMakeFiles/MADworld-obj.dir/world_task_queue.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldgop.cc.o" "world/CMakeFiles/MADworld-obj.dir/deferred_cleanup.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldmutex.cc.o" "world/CMakeFiles/MADworld-obj.dir/binary_fstream_archive.cc.o" "world/CMakeFiles/MADworld-obj.dir/text_fstream_archive.cc.o" "world/CMakeFiles/MADworld-obj.dir/lookup3.c.o" "world/CMakeFiles/MADworld-obj.dir/worldmpi.cc.o" "world/CMakeFiles/MADworld-obj.dir/group.cc.o" "world/CMakeFiles/MADworld-obj.dir/parsec.cc.o" "world/CMakeFiles/MADworld-obj.dir/archive.cc.o" "misc/CMakeFiles/MADmisc-obj.dir/checksum_file.cc.o" "misc/CMakeFiles/MADmisc-obj.dir/position_stream.cc.o" "misc/CMakeFiles/MADmisc-obj.dir/gprofexit.cc.o" "misc/CMakeFiles/MADmisc-obj.dir/ran.cc.o" "misc/CMakeFiles/MADmisc-obj.dir/cfft.cc.o" "tensor/CMakeFiles/MADtensor-obj.dir/tensor.cc.o" "tensor/CMakeFiles/MADtensor-obj.dir/tensoriter.cc.o" "tensor/CMakeFiles/MADtensor-obj.dir/basetensor.cc.o" "tensor/CMakeFiles/MADtensor-obj.dir/vmath.cc.o" "tensor/CMakeFiles/MADlinalg-obj.dir/lapack.cc.o" "tensor/CMakeFiles/MADlinalg-obj.dir/solvers.cc.o" "tensor/CMakeFiles/MADlinalg-obj.dir/elem.cc.o" "tensor/CMakeFiles/MADlinalg-obj.dir/linalg_wrappers.cc.o" "external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserBase.cpp.o" "external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserBytecode.cpp.o" "external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserCallback.cpp.o" "external/muParser/CMakeFiles/MADmuparser-obj.dir/muParser.cpp.o" "external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserError.cpp.o" "external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserTokenReader.cpp.o" "external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinystr.cc.o" "external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxml.cc.o" "external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxmlerror.cc.o" "external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxmlparser.cc.o" "mra/CMakeFiles/MADmra-obj.dir/mra1.cc.o" "mra/CMakeFiles/MADmra-obj.dir/mra2.cc.o" "mra/CMakeFiles/MADmra-obj.dir/mra3.cc.o" "mra/CMakeFiles/MADmra-obj.dir/mra4.cc.o" "mra/CMakeFiles/MADmra-obj.dir/mra5.cc.o" "mra/CMakeFiles/MADmra-obj.dir/mra6.cc.o" "mra/CMakeFiles/MADmra-obj.dir/startup.cc.o" "mra/CMakeFiles/MADmra-obj.dir/legendre.cc.o" "mra/CMakeFiles/MADmra-obj.dir/twoscale.cc.o" "mra/CMakeFiles/MADmra-obj.dir/qmprop.cc.o" cd /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra && /usr/bin/cmake -E cmake_link_script CMakeFiles/MADmra.dir/link.txt --verbose=1 +/usr/bin/ar qc libmadness.a "world/CMakeFiles/MADworld-obj.dir/madness_exception.cc.o" "world/CMakeFiles/MADworld-obj.dir/world.cc.o" "world/CMakeFiles/MADworld-obj.dir/timers.cc.o" "world/CMakeFiles/MADworld-obj.dir/future.cc.o" "world/CMakeFiles/MADworld-obj.dir/redirectio.cc.o" "world/CMakeFiles/MADworld-obj.dir/archive_type_names.cc.o" "world/CMakeFiles/MADworld-obj.dir/info.cc.o" "world/CMakeFiles/MADworld-obj.dir/debug.cc.o" "world/CMakeFiles/MADworld-obj.dir/print.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldmem.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldrmi.cc.o" "world/CMakeFiles/MADworld-obj.dir/safempi.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldpapi.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldref.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldam.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldprofile.cc.o" "world/CMakeFiles/MADworld-obj.dir/thread.cc.o" "world/CMakeFiles/MADworld-obj.dir/world_task_queue.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldgop.cc.o" "world/CMakeFiles/MADworld-obj.dir/deferred_cleanup.cc.o" "world/CMakeFiles/MADworld-obj.dir/worldmutex.cc.o" "world/CMakeFiles/MADworld-obj.dir/binary_fstream_archive.cc.o" "world/CMakeFiles/MADworld-obj.dir/text_fstream_archive.cc.o" "world/CMakeFiles/MADworld-obj.dir/lookup3.c.o" "world/CMakeFiles/MADworld-obj.dir/worldmpi.cc.o" "world/CMakeFiles/MADworld-obj.dir/group.cc.o" "world/CMakeFiles/MADworld-obj.dir/parsec.cc.o" "world/CMakeFiles/MADworld-obj.dir/archive.cc.o" "misc/CMakeFiles/MADmisc-obj.dir/checksum_file.cc.o" "misc/CMakeFiles/MADmisc-obj.dir/position_stream.cc.o" "misc/CMakeFiles/MADmisc-obj.dir/gprofexit.cc.o" "misc/CMakeFiles/MADmisc-obj.dir/ran.cc.o" "misc/CMakeFiles/MADmisc-obj.dir/cfft.cc.o" "tensor/CMakeFiles/MADtensor-obj.dir/tensor.cc.o" "tensor/CMakeFiles/MADtensor-obj.dir/tensoriter.cc.o" "tensor/CMakeFiles/MADtensor-obj.dir/basetensor.cc.o" "tensor/CMakeFiles/MADtensor-obj.dir/vmath.cc.o" "tensor/CMakeFiles/MADlinalg-obj.dir/lapack.cc.o" "tensor/CMakeFiles/MADlinalg-obj.dir/solvers.cc.o" "tensor/CMakeFiles/MADlinalg-obj.dir/elem.cc.o" "tensor/CMakeFiles/MADlinalg-obj.dir/linalg_wrappers.cc.o" "external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserBase.cpp.o" "external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserBytecode.cpp.o" "external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserCallback.cpp.o" "external/muParser/CMakeFiles/MADmuparser-obj.dir/muParser.cpp.o" "external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserError.cpp.o" "external/muParser/CMakeFiles/MADmuparser-obj.dir/muParserTokenReader.cpp.o" "external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinystr.cc.o" "external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxml.cc.o" "external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxmlerror.cc.o" "external/tinyxml/CMakeFiles/MADtinyxml-obj.dir/tinyxmlparser.cc.o" "mra/CMakeFiles/MADmra-obj.dir/mra1.cc.o" "mra/CMakeFiles/MADmra-obj.dir/mra2.cc.o" "mra/CMakeFiles/MADmra-obj.dir/mra3.cc.o" "mra/CMakeFiles/MADmra-obj.dir/mra4.cc.o" "mra/CMakeFiles/MADmra-obj.dir/mra5.cc.o" "mra/CMakeFiles/MADmra-obj.dir/mra6.cc.o" "mra/CMakeFiles/MADmra-obj.dir/startup.cc.o" "mra/CMakeFiles/MADmra-obj.dir/legendre.cc.o" "mra/CMakeFiles/MADmra-obj.dir/twoscale.cc.o" "mra/CMakeFiles/MADmra-obj.dir/qmprop.cc.o" /usr/bin/ar qc libMADmra.a "CMakeFiles/MADmra-obj.dir/mra1.cc.o" "CMakeFiles/MADmra-obj.dir/mra2.cc.o" "CMakeFiles/MADmra-obj.dir/mra3.cc.o" "CMakeFiles/MADmra-obj.dir/mra4.cc.o" "CMakeFiles/MADmra-obj.dir/mra5.cc.o" "CMakeFiles/MADmra-obj.dir/mra6.cc.o" "CMakeFiles/MADmra-obj.dir/startup.cc.o" "CMakeFiles/MADmra-obj.dir/legendre.cc.o" "CMakeFiles/MADmra-obj.dir/twoscale.cc.o" "CMakeFiles/MADmra-obj.dir/qmprop.cc.o" /usr/bin/ranlib libMADmra.a /usr/bin/ranlib libmadness.a make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' -[100%] Built target madness -make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' [100%] Built target MADmra make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' +[100%] Built target madness +make[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' [100%] Built target MADchem-obj make -f src/apps/chem/CMakeFiles/MADchem.dir/build.make src/apps/chem/CMakeFiles/MADchem.dir/depend make[3]: Entering directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' @@ -2329,14 +2365,14 @@ 1: gmake[4]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 1: gmake[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 1: - 1/56 Test #1: build_world_unittests ................... Passed 179.37 sec + 1/56 Test #1: build_world_unittests ................... Passed 479.65 sec test 2 Start 2: world-test_prof 2: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_prof 2: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 2: Test timeout computed to be: 1500 -2: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +2: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 2: from main before sum=137.934299 2: from A before sum=137.934299 2: from B before sum=137.934299 @@ -2348,8 +2384,8 @@ 2: Parallel environment 2: -------------------- 2: #nodes 1 -2: #threads per node 63+main = 64 -2: #total threads 64 +2: #threads per node 127+main = 128 +2: #total threads 128 2: 2: RMI message statistics (min / avg / max) 2: ---------------------- @@ -2367,19 +2403,55 @@ 2: #max q len per node 0.00e+00 / 0.00e+00 / 0.00e+00 2: #hi-pri tasks per node 0.00e+00 / 0.00e+00 / 0.00e+00 2: -2: Total wall time 0.1s -2: Total cpu time 0.1s +2: Total wall time 0.2s +2: Total cpu time 0.2s 2: 2: MADNESS runtime finalized but 1 world still exists - 2/56 Test #2: world-test_prof ......................... Passed 0.30 sec + 2/56 Test #2: world-test_prof .........................***Timeout 1500.12 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +from main before sum=137.934299 +from A before sum=137.934299 +from B before sum=137.934299 +from A::member sum=137.934299 +from B after sum=275.868598 +from A after sum=275.868598 +from main after sum=275.868598 + + Parallel environment + -------------------- + #nodes 1 + #threads per node 127+main = 128 + #total threads 128 + + RMI message statistics (min / avg / max) + ---------------------- + #messages in server q 0.00e+00 / 0.00e+00 / 0.00e+00 + #messages sent per node 0.00e+00 / 0.00e+00 / 0.00e+00 + #bytes sent per node 0.00e+00 / 0.00e+00 / 0.00e+00 + #messages recv per node 0.00e+00 / 0.00e+00 / 0.00e+00 + #bytes recv per node 0.00e+00 / 0.00e+00 / 0.00e+00 + #msgs systemwide 0.00e+00 + #bytes systemwide 0.00e+00 + + Thread pool statistics (min / avg / max) + ---------------------- + #tasks per node 0.00e+00 / 0.00e+00 / 0.00e+00 + #max q len per node 0.00e+00 / 0.00e+00 / 0.00e+00 + #hi-pri tasks per node 0.00e+00 / 0.00e+00 / 0.00e+00 + + Total wall time 0.2s + Total cpu time 0.2s + +MADNESS runtime finalized but 1 world still exists + test 3 Start 3: world-test_ar 3: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_ar 3: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 3: Test timeout computed to be: 1500 -3: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 -3: rank=0 fn_ptr_origin=55cb660d4080 +3: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +3: rank=0 fn_ptr_origin=56014ee9f080 3: 3: testing binary fstream archive 3: 0 --> 1 --> 2 --> 3 @@ -2408,28 +2480,68 @@ 3: error in pi 0.000000e+00 3: error in e 0.000000e+00 3: Serialization appears to work. - 3/56 Test #3: world-test_ar ........................... Passed 0.22 sec + 3/56 Test #3: world-test_ar ...........................***Timeout 1500.21 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +rank=0 fn_ptr_origin=56014ee9f080 + +testing binary fstream archive +0 --> 1 --> 2 --> 3 +0 --> 1 --> 2 --> 3 +error in pi 0.000000e+00 +error in e 0.000000e+00 +Serialization appears to work. + +testing vector archive +0 --> 1 --> 2 --> 3 +0 --> 1 --> 2 --> 3 +error in pi 0.000000e+00 +error in e 0.000000e+00 +Serialization appears to work. + +testing text fstream archive +0 --> 1 --> 2 --> 3 +0 --> 1 --> 2 --> 3 +error in pi 0.000000e+00 +error in e 0.000000e+00 +Serialization appears to work. + +testing buffer archive +0 --> 1 --> 2 --> 3 +0 --> 1 --> 2 --> 3 +error in pi 0.000000e+00 +error in e 0.000000e+00 +Serialization appears to work. + test 4 Start 4: world-test_hashdc 4: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_hashdc 4: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 4: Test timeout computed to be: 1500 -4: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +4: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 4: 99 4: (Key(99),99)(Key(99),99)(Key(99),99) 4: (Key(99),99) 4: MADNESS runtime finalized but 1 world still exists - 4/56 Test #4: world-test_hashdc ....................... Passed 0.19 sec + 4/56 Test #4: world-test_hashdc .......................***Timeout 1500.21 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +99 +(Key(99),99)(Key(99),99)(Key(99),99) +(Key(99),99) +MADNESS runtime finalized but 1 world still exists + test 5 Start 5: world-test_hello 5: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_hello 5: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 5: Test timeout computed to be: 1500 -5: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +5: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 5: Hello from 0 - 5/56 Test #5: world-test_hello ........................ Passed 0.20 sec + 5/56 Test #5: world-test_hello ........................***Timeout 1500.19 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +Hello from 0 + test 6 Start 6: world-test_atomicint @@ -2437,28 +2549,38 @@ 6: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 6: Test timeout computed to be: 1500 6: small test : 0 -6: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +6: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 6: SUM 300000000 6: HI 6: SUM 10000000 - 6/56 Test #6: world-test_atomicint .................... Passed 116.56 sec + 6/56 Test #6: world-test_atomicint ....................***Timeout 1500.18 sec +small test : 0 +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +SUM 300000000 +HI +SUM 10000000 + test 7 Start 7: world-test_future 7: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_future 7: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 7: Test timeout computed to be: 1500 -7: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +7: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 7: Helloab donea 7: MADNESS runtime finalized but 1 world still exists - 7/56 Test #7: world-test_future ....................... Passed 0.21 sec + 7/56 Test #7: world-test_future .......................***Timeout 1500.16 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +Helloab donea +MADNESS runtime finalized but 1 world still exists + test 8 Start 8: world-test_future2 8: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_future2 8: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 8: Test timeout computed to be: 1500 -8: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +8: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 8: data size 10000 8: World size is 1 8: write section ends @@ -2474,24 +2596,41 @@ 8: rank 0: 6301th data is owned by 0 8: OK! 8: MADNESS runtime finalized but 1 world still exists - 8/56 Test #8: world-test_future2 ...................... Passed 0.23 sec + 8/56 Test #8: world-test_future2 ......................***Timeout 1500.21 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +data size 10000 +World size is 1 +write section ends +rank 0: 7271th data is owned by 0 +rank 0: 86th data is owned by 0 +rank 0: 1177th data is owned by 0 +rank 0: 883th data is owned by 0 +rank 0: 737th data is owned by 0 +rank 0: 7935th data is owned by 0 +rank 0: 2314th data is owned by 0 +rank 0: 3324th data is owned by 0 +rank 0: 4089th data is owned by 0 +rank 0: 6301th data is owned by 0 +OK! +MADNESS runtime finalized but 1 world still exists + test 9 Start 9: world-test_future3 9: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_future3 9: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 9: Test timeout computed to be: 1500 -9: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +9: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 9: OK! 9: MADNESS runtime finalized but 1 world still exists - 9/56 Test #9: world-test_future3 ...................... Passed 0.20 sec + 9/56 Test #9: world-test_future3 ...................... Passed 0.41 sec test 10 Start 10: world-test_dc 10: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_dc 10: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 10: Test timeout computed to be: 1500 -10: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +10: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 10: count after constructor 0 10: count after making 300 10: data distribution info before redistributing @@ -2538,14 +2677,62 @@ 10: count after first fence 0 10: count after second fence 0 10: MADNESS runtime finalized but 1 world still exists -10/56 Test #10: world-test_dc ........................... Passed 0.20 sec +10/56 Test #10: world-test_dc ...........................***Timeout 1500.18 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +count after constructor 0 +count after making 300 +data distribution info before redistributing + total: 300 + procs: 300 +data distribution info after redistributing + total: 300 + procs: 300 +count after redistributing 300 +count after from global sz 300 +count after testing 300 +count after clearing c 200 +count after going out of scope without fence 200 +count after first fence 0 +count after second fence 0 +count after constructor 0 +count after making 300 +data distribution info before redistributing + total: 300 + procs: 300 +data distribution info after redistributing + total: 300 + procs: 300 +count after redistributing 300 +count after from global sz 300 +count after testing 300 +count after clearing c 200 +count after going out of scope without fence 200 +count after first fence 0 +count after second fence 0 +count after constructor 0 +count after making 300 +data distribution info before redistributing + total: 300 + procs: 300 +data distribution info after redistributing + total: 300 + procs: 300 +count after redistributing 300 +count after from global sz 300 +count after testing 300 +count after clearing c 200 +count after going out of scope without fence 200 +count after first fence 0 +count after second fence 0 +MADNESS runtime finalized but 1 world still exists + test 11 Start 11: world-test_hashthreaded 11: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_hashthreaded 11: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 11: Test timeout computed to be: 1500 -11: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +11: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 11: small test : 0 11: nelem 1 11: stride 1 @@ -2617,17 +2804,100 @@ 11: stride 11 11: stride 12 11: stride 13 -11: nbin= 100 nent= 100 insert=1.1e-07s/call del=7.5e-08s/call -11: nbin= 100 nent= 1000 insert=1.3e-07s/call del=1.1e-07s/call -11: nbin= 100 nent= 10000 insert=2.2e-06s/call del=2.1e-06s/call -11: nbin= 1000 nent= 1000 insert=9.9e-08s/call del=7.4e-08s/call -11: nbin= 1000 nent= 10000 insert=1.7e-07s/call del=1.7e-07s/call -11: nbin= 1000 nent= 100000 insert=4.1e-06s/call del=1.9e-06s/call -11: nbin= 10000 nent= 10000 insert=1.3e-07s/call del=9.1e-08s/call -11: nbin= 10000 nent= 100000 insert=3.4e-07s/call del=2.9e-07s/call -11: nbin= 10000 nent= 1000000 insert=1.2e-05s/call del=1.4e-05s/call +11: nbin= 100 nent= 100 insert=1.2e-07s/call del=7.6e-08s/call +11: nbin= 100 nent= 1000 insert=1.4e-07s/call del=9.3e-08s/call +11: nbin= 100 nent= 10000 insert=6.0e-06s/call del=7.6e-06s/call +11: nbin= 1000 nent= 1000 insert=1.1e-07s/call del=7.3e-08s/call +11: nbin= 1000 nent= 10000 insert=2.0e-07s/call del=1.5e-07s/call +11: nbin= 1000 nent= 100000 insert=2.8e-05s/call del=1.6e-05s/call +11: nbin= 10000 nent= 10000 insert=1.1e-07s/call del=8.5e-08s/call +11: nbin= 10000 nent= 100000 insert=1.6e-06s/call del=1.3e-06s/call +11: nbin= 10000 nent= 1000000 insert=3.4e-05s/call del=2.8e-05s/call 11: Things seem to be working! -11/56 Test #11: world-test_hashthreaded ................. Passed 150.29 sec +11/56 Test #11: world-test_hashthreaded .................***Timeout 1500.14 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +small test : 0 +nelem 1 + stride 1 + stride 2 + stride 3 + stride 4 + stride 5 + stride 6 + stride 7 + stride 8 + stride 9 + stride 10 + stride 11 + stride 12 + stride 13 +nelem 10 + stride 1 + stride 2 + stride 3 + stride 4 + stride 5 + stride 6 + stride 7 + stride 8 + stride 9 + stride 10 + stride 11 + stride 12 + stride 13 +nelem 100 + stride 1 + stride 2 + stride 3 + stride 4 + stride 5 + stride 6 + stride 7 + stride 8 + stride 9 + stride 10 + stride 11 + stride 12 + stride 13 +nelem 1000 + stride 1 + stride 2 + stride 3 + stride 4 + stride 5 + stride 6 + stride 7 + stride 8 + stride 9 + stride 10 + stride 11 + stride 12 + stride 13 +nelem 10000 + stride 1 + stride 2 + stride 3 + stride 4 + stride 5 + stride 6 + stride 7 + stride 8 + stride 9 + stride 10 + stride 11 + stride 12 + stride 13 +nbin= 100 nent= 100 insert=1.2e-07s/call del=7.6e-08s/call +nbin= 100 nent= 1000 insert=1.4e-07s/call del=9.3e-08s/call +nbin= 100 nent= 10000 insert=6.0e-06s/call del=7.6e-06s/call +nbin= 1000 nent= 1000 insert=1.1e-07s/call del=7.3e-08s/call +nbin= 1000 nent= 10000 insert=2.0e-07s/call del=1.5e-07s/call +nbin= 1000 nent= 100000 insert=2.8e-05s/call del=1.6e-05s/call +nbin= 10000 nent= 10000 insert=1.1e-07s/call del=8.5e-08s/call +nbin= 10000 nent= 100000 insert=1.6e-06s/call del=1.3e-06s/call +nbin= 10000 nent= 1000000 insert=3.4e-05s/call del=2.8e-05s/call +Things seem to be working! + test 12 Start 12: world-test_queue @@ -2635,103 +2905,311 @@ 12: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 12: Test timeout computed to be: 1500 12: small test : 0 -12: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +12: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 12: Total tasks = 10000000 -12: Total runtime = 4.68137 (s) +12: Total runtime = 3.43405 (s) 12: Tasks per thread: -12: 0 72054 -12: 1 240731 -12: 2 105876 -12: 3 108088 -12: 4 147560 -12: 5 128953 -12: 6 191754 -12: 7 153023 -12: 8 174035 -12: 9 128228 -12: 10 123320 -12: 11 157745 -12: 12 149764 -12: 13 114596 -12: 14 178997 -12: 15 228929 -12: 16 169006 -12: 17 248162 -12: 18 159648 -12: 19 110556 -12: 20 112511 -12: 21 112855 -12: 22 123196 -12: 23 167052 -12: 24 188611 -12: 25 167184 -12: 26 121992 -12: 27 183982 -12: 28 107900 -12: 29 159987 -12: 30 108259 -12: 31 119368 -12: 32 112071 -12: 33 173075 -12: 34 123484 -12: 35 136054 -12: 36 238508 -12: 37 128572 -12: 38 209338 -12: 39 133717 -12: 40 164025 -12: 41 135372 -12: 42 216666 -12: 43 215329 -12: 44 119641 -12: 45 229804 -12: 46 213317 -12: 47 132092 -12: 48 150772 -12: 49 114445 -12: 50 202768 -12: 51 141123 -12: 52 136822 -12: 53 166660 -12: 54 174528 -12: 55 215086 -12: 56 121256 -12: 57 142109 -12: 58 187471 -12: 59 108181 -12: 60 174555 -12: 61 204809 -12: 62 150060 -12: 63 164368 +12: 0 94053 +12: 1 211941 +12: 2 192110 +12: 3 240332 +12: 4 176794 +12: 5 275122 +12: 6 151080 +12: 7 154239 +12: 8 209469 +12: 9 179997 +12: 10 155405 +12: 11 174281 +12: 12 173862 +12: 13 222038 +12: 14 139823 +12: 15 152244 +12: 16 142996 +12: 17 202077 +12: 18 200646 +12: 19 173332 +12: 20 207693 +12: 21 178741 +12: 22 134792 +12: 23 124752 +12: 24 134575 +12: 25 121315 +12: 26 147162 +12: 27 102792 +12: 28 108504 +12: 29 153876 +12: 30 168895 +12: 31 203490 +12: 32 172624 +12: 33 112364 +12: 34 135828 +12: 35 142199 +12: 36 158343 +12: 37 110757 +12: 38 184420 +12: 39 120144 +12: 40 165859 +12: 41 200145 +12: 42 140722 +12: 43 110953 +12: 44 118048 +12: 45 151593 +12: 46 149361 +12: 47 122325 +12: 48 119979 +12: 49 99147 +12: 50 100890 +12: 51 161089 +12: 52 135196 +12: 53 132468 +12: 54 189349 +12: 55 162173 +12: 56 117640 +12: 57 124800 +12: 58 105469 +12: 59 179071 +12: 60 190323 +12: 61 174041 +12: 62 136249 +12: 63 168003 +12: 64 0 +12: 65 0 +12: 66 0 +12: 67 0 +12: 68 0 +12: 69 0 +12: 70 0 +12: 71 0 +12: 72 0 +12: 73 0 +12: 74 0 +12: 75 0 +12: 76 0 +12: 77 0 +12: 78 0 +12: 79 0 +12: 80 0 +12: 81 0 +12: 82 0 +12: 83 0 +12: 84 0 +12: 85 0 +12: 86 0 +12: 87 0 +12: 88 0 +12: 89 0 +12: 90 0 +12: 91 0 +12: 92 0 +12: 93 0 +12: 94 0 +12: 95 0 +12: 96 0 +12: 97 0 +12: 98 0 +12: 99 0 +12: 100 0 +12: 101 0 +12: 102 0 +12: 103 0 +12: 104 0 +12: 105 0 +12: 106 0 +12: 107 0 +12: 108 0 +12: 109 0 +12: 110 0 +12: 111 0 +12: 112 0 +12: 113 0 +12: 114 0 +12: 115 0 +12: 116 0 +12: 117 0 +12: 118 0 +12: 119 0 +12: 120 0 +12: 121 0 +12: 122 0 +12: 123 0 +12: 124 0 +12: 125 0 +12: 126 0 +12: 127 0 12: MADNESS runtime finalized but 1 world still exists -12/56 Test #12: world-test_queue ........................ Passed 4.86 sec +12/56 Test #12: world-test_queue ........................***Timeout 1500.18 sec +small test : 0 +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +Total tasks = 10000000 +Total runtime = 3.43405 (s) +Tasks per thread: +0 94053 +1 211941 +2 192110 +3 240332 +4 176794 +5 275122 +6 151080 +7 154239 +8 209469 +9 179997 +10 155405 +11 174281 +12 173862 +13 222038 +14 139823 +15 152244 +16 142996 +17 202077 +18 200646 +19 173332 +20 207693 +21 178741 +22 134792 +23 124752 +24 134575 +25 121315 +26 147162 +27 102792 +28 108504 +29 153876 +30 168895 +31 203490 +32 172624 +33 112364 +34 135828 +35 142199 +36 158343 +37 110757 +38 184420 +39 120144 +40 165859 +41 200145 +42 140722 +43 110953 +44 118048 +45 151593 +46 149361 +47 122325 +48 119979 +49 99147 +50 100890 +51 161089 +52 135196 +53 132468 +54 189349 +55 162173 +56 117640 +57 124800 +58 105469 +59 179071 +60 190323 +61 174041 +62 136249 +63 168003 +64 0 +65 0 +66 0 +67 0 +68 0 +69 0 +70 0 +71 0 +72 0 +73 0 +74 0 +75 0 +76 0 +77 0 +78 0 +79 0 +80 0 +81 0 +82 0 +83 0 +84 0 +85 0 +86 0 +87 0 +88 0 +89 0 +90 0 +91 0 +92 0 +93 0 +94 0 +95 0 +96 0 +97 0 +98 0 +99 0 +100 0 +101 0 +102 0 +103 0 +104 0 +105 0 +106 0 +107 0 +108 0 +109 0 +110 0 +111 0 +112 0 +113 0 +114 0 +115 0 +116 0 +117 0 +118 0 +119 0 +120 0 +121 0 +122 0 +123 0 +124 0 +125 0 +126 0 +127 0 +MADNESS runtime finalized but 1 world still exists + test 13 Start 13: world-test_world 13: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_world 13: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 13: Test timeout computed to be: 1500 -13: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 -13/56 Test #13: world-test_world ........................ Passed 26.89 sec +13: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +13/56 Test #13: world-test_world ........................***Timeout 1500.15 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 + test 14 Start 14: world-test_worldprofile 14: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_worldprofile 14: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 14: Test timeout computed to be: 1500 -14: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 -14/56 Test #14: world-test_worldprofile ................. Passed 0.22 sec +14: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +14/56 Test #14: world-test_worldprofile .................***Timeout 1500.14 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 + test 15 Start 15: world-test_binsorter 15: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_binsorter 15: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 15: Test timeout computed to be: 1500 -15: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +15: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 15: 9.78761 9.78761 15: OK? 1 15: MADNESS runtime finalized but 1 world still exists -15/56 Test #15: world-test_binsorter .................... Passed 0.20 sec +15/56 Test #15: world-test_binsorter ....................***Timeout 1500.16 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +9.78761 9.78761 +OK? 1 +MADNESS runtime finalized but 1 world still exists + test 16 Start 16: world-test_vector @@ -2752,14 +3230,14 @@ 16: [----------] Global test environment tear-down 16: [==========] 3 tests from 1 test case ran. (0 ms total) 16: [ PASSED ] 3 tests. -16/56 Test #16: world-test_vector ....................... Passed 0.01 sec +16/56 Test #16: world-test_vector ....................... Passed 0.02 sec test 17 Start 17: world-test_worldptr 17: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_worldptr 17: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 17: Test timeout computed to be: 1500 -17: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +17: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 17: [==========] Running 14 tests from 1 test case. 17: [----------] Global test environment set-up. 17: [----------] 14 tests from WorldPtrTest @@ -2797,14 +3275,14 @@ 17: [==========] 14 tests from 1 test case ran. (0 ms total) 17: [ PASSED ] 14 tests. 17: MADNESS runtime finalized but 1 world still exists -17/56 Test #17: world-test_worldptr ..................... Passed 0.37 sec +17/56 Test #17: world-test_worldptr ..................... Passed 0.30 sec test 18 Start 18: world-test_worldref 18: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_worldref 18: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 18: Test timeout computed to be: 1500 -18: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +18: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 18: [==========] Running 15 tests from 1 test case. 18: [----------] Global test environment set-up. 18: [----------] 15 tests from WorldRefTest @@ -2838,13 +3316,54 @@ 18: [ OK ] WorldRefTest.Serialize (0 ms) 18: [ RUN ] WorldRefTest.RemoteRef 18: [ OK ] WorldRefTest.RemoteRef (0 ms) -18: [----------] 15 tests from WorldRefTest (1 ms total) +18: [----------] 15 tests from WorldRefTest (0 ms total) 18: 18: [----------] Global test environment tear-down -18: [==========] 15 tests from 1 test case ran. (1 ms total) +18: [==========] 15 tests from 1 test case ran. (0 ms total) 18: [ PASSED ] 15 tests. 18: MADNESS runtime finalized but 1 world still exists -18/56 Test #18: world-test_worldref ..................... Passed 0.20 sec +18/56 Test #18: world-test_worldref .....................***Timeout 1500.17 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +[==========] Running 15 tests from 1 test case. +[----------] Global test environment set-up. +[----------] 15 tests from WorldRefTest +[ RUN ] WorldRefTest.DefaultConstructor +[ OK ] WorldRefTest.DefaultConstructor (0 ms) +[ RUN ] WorldRefTest.PointerConstructor +[ OK ] WorldRefTest.PointerConstructor (0 ms) +[ RUN ] WorldRefTest.CopyConstructor +[ OK ] WorldRefTest.CopyConstructor (0 ms) +[ RUN ] WorldRefTest.CopyConversionConstructor +[ OK ] WorldRefTest.CopyConversionConstructor (0 ms) +[ RUN ] WorldRefTest.CopyAssignment +[ OK ] WorldRefTest.CopyAssignment (0 ms) +[ RUN ] WorldRefTest.CopyConversionAssignment +[ OK ] WorldRefTest.CopyConversionAssignment (0 ms) +[ RUN ] WorldRefTest.Counter +[ OK ] WorldRefTest.Counter (0 ms) +[ RUN ] WorldRefTest.Pointer +[ OK ] WorldRefTest.Pointer (0 ms) +[ RUN ] WorldRefTest.Ownership +[ OK ] WorldRefTest.Ownership (0 ms) +[ RUN ] WorldRefTest.World +[ OK ] WorldRefTest.World (0 ms) +[ RUN ] WorldRefTest.Reset +[ OK ] WorldRefTest.Reset (0 ms) +[ RUN ] WorldRefTest.Boolean +[ OK ] WorldRefTest.Boolean (0 ms) +[ RUN ] WorldRefTest.Swap +[ OK ] WorldRefTest.Swap (0 ms) +[ RUN ] WorldRefTest.Serialize +[ OK ] WorldRefTest.Serialize (0 ms) +[ RUN ] WorldRefTest.RemoteRef +[ OK ] WorldRefTest.RemoteRef (0 ms) +[----------] 15 tests from WorldRefTest (0 ms total) + +[----------] Global test environment tear-down +[==========] 15 tests from 1 test case ran. (0 ms total) +[ PASSED ] 15 tests. +MADNESS runtime finalized but 1 world still exists + test 19 Start 19: world-test_stack @@ -2887,7 +3406,7 @@ 19: [ RUN ] StackTest/2.DefaultConstructor 19: [ OK ] StackTest/2.DefaultConstructor (0 ms) 19: [ RUN ] StackTest/2.PushPop -19: [ OK ] StackTest/2.PushPop (0 ms) +19: [ OK ] StackTest/2.PushPop (4 ms) 19: [ RUN ] StackTest/2.CopyCtor 19: [ OK ] StackTest/2.CopyCtor (0 ms) 19: [ RUN ] StackTest/2.MoveCtor @@ -2896,13 +3415,13 @@ 19: [ OK ] StackTest/2.CopyAssign (0 ms) 19: [ RUN ] StackTest/2.MoveAssign 19: [ OK ] StackTest/2.MoveAssign (0 ms) -19: [----------] 6 tests from StackTest/2 (0 ms total) +19: [----------] 6 tests from StackTest/2 (4 ms total) 19: 19: [----------] 6 tests from StackTest/3, where TypeParam = (anonymous namespace)::C 19: [ RUN ] StackTest/3.DefaultConstructor 19: [ OK ] StackTest/3.DefaultConstructor (0 ms) 19: [ RUN ] StackTest/3.PushPop -19: [ OK ] StackTest/3.PushPop (0 ms) +19: [ OK ] StackTest/3.PushPop (1 ms) 19: [ RUN ] StackTest/3.CopyCtor 19: [ OK ] StackTest/3.CopyCtor (0 ms) 19: [ RUN ] StackTest/3.MoveCtor @@ -2911,19 +3430,19 @@ 19: [ OK ] StackTest/3.CopyAssign (0 ms) 19: [ RUN ] StackTest/3.MoveAssign 19: [ OK ] StackTest/3.MoveAssign (0 ms) -19: [----------] 6 tests from StackTest/3 (0 ms total) +19: [----------] 6 tests from StackTest/3 (1 ms total) 19: 19: [----------] Global test environment tear-down -19: [==========] 24 tests from 4 test cases ran. (0 ms total) +19: [==========] 24 tests from 4 test cases ran. (5 ms total) 19: [ PASSED ] 24 tests. -19/56 Test #19: world-test_stack ........................ Passed 0.01 sec +19/56 Test #19: world-test_stack ........................ Passed 0.02 sec test 20 Start 20: world-test_googletest 20: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_googletest 20: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 20: Test timeout computed to be: 1500 -20: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +20: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 20: [==========] Running 2 tests from 1 test case. 20: [----------] Global test environment set-up. 20: [----------] 2 tests from WorldTest @@ -2952,15 +3471,47 @@ 20: 20: 1 FAILED TEST 20: MADNESS runtime finalized but 1 world still exists -20/56 Test #20: world-test_googletest ................... Passed 0.20 sec +20/56 Test #20: world-test_googletest ...................***Timeout 1500.16 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +[==========] Running 2 tests from 1 test case. +[----------] Global test environment set-up. +[----------] 2 tests from WorldTest +[ RUN ] WorldTest.Something +Inside WorldTest +Inside WorldSetUp +Inside WorldTestDown +Inside ~WorldTest +[ OK ] WorldTest.Something (0 ms) +[ RUN ] WorldTest.Else +Inside WorldTest +Inside WorldSetUp +./src/madness/world/test_googletest.cc:77: Failure +Value of: 2 +Expected: 1 +Inside WorldTestDown +Inside ~WorldTest +[ FAILED ] WorldTest.Else (0 ms) +[----------] 2 tests from WorldTest (0 ms total) + +[----------] Global test environment tear-down +[==========] 2 tests from 1 test case ran. (0 ms total) +[ PASSED ] 1 test. +[ FAILED ] 1 test, listed below: +[ FAILED ] WorldTest.Else + + 1 FAILED TEST +MADNESS runtime finalized but 1 world still exists + test 21 Start 21: world-test_tree 21: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world/test_tree 21: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/world 21: Test timeout computed to be: 1500 -21: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 -21/56 Test #21: world-test_tree ......................... Passed 0.36 sec +21: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +21/56 Test #21: world-test_tree .........................***Timeout 1500.18 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 + test 22 Start 22: build_misc_unittests @@ -3056,7 +3607,7 @@ 22: gmake[4]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 22: gmake[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 22: -22/56 Test #22: build_misc_unittests .................... Passed 2.03 sec +22/56 Test #22: build_misc_unittests .................... Passed 3.96 sec test 23 Start 23: misc-interp3 @@ -3064,7 +3615,7 @@ 23: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/misc 23: Test timeout computed to be: 1500 23: maxerr 1.95399252334e-14 -23/56 Test #23: misc-interp3 ............................ Passed 0.06 sec +23/56 Test #23: misc-interp3 ............................ Passed 0.13 sec test 24 Start 24: build_tensor_unittests @@ -3281,7 +3832,7 @@ 24: gmake[4]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 24: gmake[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 24: -24/56 Test #24: build_tensor_unittests .................. Passed 154.60 sec +24/56 Test #24: build_tensor_unittests .................. Passed 295.40 sec test 25 Start 25: tensor-test_tensor @@ -3292,7 +3843,7 @@ 25: [----------] Global test environment set-up. 25: [----------] 5 tests from TensorTest/0, where TypeParam = int 25: [ RUN ] TensorTest/0.Basic -25: [ OK ] TensorTest/0.Basic (19 ms) +25: [ OK ] TensorTest/0.Basic (17 ms) 25: [ RUN ] TensorTest/0.Slicing1d 25: [ OK ] TensorTest/0.Slicing1d (0 ms) 25: [ RUN ] TensorTest/0.SliceAndDice @@ -3300,78 +3851,78 @@ 25: [ RUN ] TensorTest/0.Transpose 25: [ OK ] TensorTest/0.Transpose (1 ms) 25: [ RUN ] TensorTest/0.Reshaping -25: [ OK ] TensorTest/0.Reshaping (0 ms) -25: [----------] 5 tests from TensorTest/0 (20 ms total) +25: [ OK ] TensorTest/0.Reshaping (5 ms) +25: [----------] 5 tests from TensorTest/0 (23 ms total) 25: 25: [----------] 5 tests from TensorTest/1, where TypeParam = long 25: [ RUN ] TensorTest/1.Basic -25: [ OK ] TensorTest/1.Basic (5 ms) +25: [ OK ] TensorTest/1.Basic (7 ms) 25: [ RUN ] TensorTest/1.Slicing1d 25: [ OK ] TensorTest/1.Slicing1d (0 ms) 25: [ RUN ] TensorTest/1.SliceAndDice 25: [ OK ] TensorTest/1.SliceAndDice (0 ms) 25: [ RUN ] TensorTest/1.Transpose -25: [ OK ] TensorTest/1.Transpose (1 ms) +25: [ OK ] TensorTest/1.Transpose (0 ms) 25: [ RUN ] TensorTest/1.Reshaping 25: [ OK ] TensorTest/1.Reshaping (0 ms) -25: [----------] 5 tests from TensorTest/1 (6 ms total) +25: [----------] 5 tests from TensorTest/1 (8 ms total) 25: 25: [----------] 5 tests from TensorTest/2, where TypeParam = float 25: [ RUN ] TensorTest/2.Basic -25: [ OK ] TensorTest/2.Basic (8 ms) +25: [ OK ] TensorTest/2.Basic (14 ms) 25: [ RUN ] TensorTest/2.Slicing1d 25: [ OK ] TensorTest/2.Slicing1d (0 ms) 25: [ RUN ] TensorTest/2.SliceAndDice -25: [ OK ] TensorTest/2.SliceAndDice (0 ms) +25: [ OK ] TensorTest/2.SliceAndDice (1 ms) 25: [ RUN ] TensorTest/2.Transpose 25: [ OK ] TensorTest/2.Transpose (0 ms) 25: [ RUN ] TensorTest/2.Reshaping 25: [ OK ] TensorTest/2.Reshaping (0 ms) -25: [----------] 5 tests from TensorTest/2 (8 ms total) +25: [----------] 5 tests from TensorTest/2 (19 ms total) 25: 25: [----------] 5 tests from TensorTest/3, where TypeParam = double 25: [ RUN ] TensorTest/3.Basic -25: [ OK ] TensorTest/3.Basic (4 ms) +25: [ OK ] TensorTest/3.Basic (8 ms) 25: [ RUN ] TensorTest/3.Slicing1d 25: [ OK ] TensorTest/3.Slicing1d (0 ms) 25: [ RUN ] TensorTest/3.SliceAndDice 25: [ OK ] TensorTest/3.SliceAndDice (0 ms) 25: [ RUN ] TensorTest/3.Transpose -25: [ OK ] TensorTest/3.Transpose (1 ms) +25: [ OK ] TensorTest/3.Transpose (0 ms) 25: [ RUN ] TensorTest/3.Reshaping 25: [ OK ] TensorTest/3.Reshaping (0 ms) -25: [----------] 5 tests from TensorTest/3 (5 ms total) +25: [----------] 5 tests from TensorTest/3 (9 ms total) 25: 25: [----------] 5 tests from TensorTest/4, where TypeParam = std::complex 25: [ RUN ] TensorTest/4.Basic -25: [ OK ] TensorTest/4.Basic (4 ms) +25: [ OK ] TensorTest/4.Basic (5 ms) 25: [ RUN ] TensorTest/4.Slicing1d 25: [ OK ] TensorTest/4.Slicing1d (0 ms) 25: [ RUN ] TensorTest/4.SliceAndDice -25: [ OK ] TensorTest/4.SliceAndDice (1 ms) +25: [ OK ] TensorTest/4.SliceAndDice (0 ms) 25: [ RUN ] TensorTest/4.Transpose 25: [ OK ] TensorTest/4.Transpose (0 ms) 25: [ RUN ] TensorTest/4.Reshaping 25: [ OK ] TensorTest/4.Reshaping (0 ms) -25: [----------] 5 tests from TensorTest/4 (5 ms total) +25: [----------] 5 tests from TensorTest/4 (12 ms total) 25: 25: [----------] 5 tests from TensorTest/5, where TypeParam = std::complex 25: [ RUN ] TensorTest/5.Basic -25: [ OK ] TensorTest/5.Basic (13 ms) +25: [ OK ] TensorTest/5.Basic (23 ms) 25: [ RUN ] TensorTest/5.Slicing1d 25: [ OK ] TensorTest/5.Slicing1d (0 ms) 25: [ RUN ] TensorTest/5.SliceAndDice 25: [ OK ] TensorTest/5.SliceAndDice (0 ms) 25: [ RUN ] TensorTest/5.Transpose -25: [ OK ] TensorTest/5.Transpose (1 ms) +25: [ OK ] TensorTest/5.Transpose (0 ms) 25: [ RUN ] TensorTest/5.Reshaping -25: [ OK ] TensorTest/5.Reshaping (0 ms) -25: [----------] 5 tests from TensorTest/5 (14 ms total) +25: [ OK ] TensorTest/5.Reshaping (1 ms) +25: [----------] 5 tests from TensorTest/5 (25 ms total) 25: 25: [----------] Global test environment tear-down -25: [==========] 30 tests from 6 test cases ran. (59 ms total) +25: [==========] 30 tests from 6 test cases ran. (97 ms total) 25: [ PASSED ] 30 tests. -25/56 Test #25: tensor-test_tensor ...................... Passed 0.07 sec +25/56 Test #25: tensor-test_tensor ...................... Passed 0.12 sec test 26 Start 26: tensor-oldtest @@ -3664,7 +4215,7 @@ 26: [5,*] 0.33149500 0.08960122 -0.30843641 0.29759492 -0.05619673 0.04010210 0.45044425 0.16708594 26: [6,*] -0.30772380 -0.02504389 -0.31501939 -0.46608584 -0.23087815 -0.15784214 0.00800091 -0.45405219 26: [7,*] -0.26379890 -0.33894150 0.19107575 0.26229331 0.32673166 -0.28439306 -0.15519180 -0.08980275 -26: TRANSFORM MOPS=1.221775e+03 3.258630e-01 +26: TRANSFORM MOPS=1.394139e+03 2.855750e-01 26: Test7 OK 26: [0,*] 0.37258124 -0.49952751 -0.25496480 0.04929388 -0.19749206 -0.49935344 0.28301728 -0.00667718 26: [1,*] -0.48838624 0.15726274 0.26025498 0.26724589 -0.20811012 -0.37447649 -0.16809446 -0.22237402 @@ -3674,7 +4225,7 @@ 26: [5,*] 0.22898686 -0.11340395 -0.24177271 0.04802269 -0.43062589 0.33717400 0.07783371 0.45109630 26: [6,*] -0.23378491 0.30305308 0.24609971 -0.09605372 -0.34217095 0.21689934 0.19800431 0.49755073 26: [7,*] 0.10748863 -0.38455153 0.41225362 0.44050258 -0.46733639 -0.05386999 -0.15734968 0.23180145 -26: TRANSFORM MOPS=1.586667e+03 2.509230e-01 +26: TRANSFORM MOPS=1.393158e+03 2.857760e-01 26: Test7 OK 26: [0,*] (-0.33518440,0.40357217) (-0.17473283,0.82070410) (-0.01585835,0.30722934) (-0.10463598,0.53139055) (0.42974538,0.80602288) (0.04878730,0.81677061) (0.44425398,0.85733587) (-0.29166049,0.53121889) 26: [1,*] (0.37691134,0.79058260) (0.26496691,0.38599995) (0.30913788,0.70016384) (0.04523838,0.12896948) (0.47609943,0.52484506) (-0.38288075,0.31095162) (0.31768924,0.34667173) (0.04381561,0.31462812) @@ -3684,7 +4235,7 @@ 26: [5,*] (0.30336678,0.74079227) (0.11002743,0.76288539) (-0.06467077,0.64183664) (0.17587787,0.81293410) (-0.26850542,0.71055275) (0.08655286,0.80521709) (-0.18343061,0.93971467) (-0.24734113,0.77711433) 26: [6,*] (-0.07770854,0.35136056) (0.22223508,0.90042019) (-0.15083373,0.91546267) (0.18045902,0.57162702) (0.21359932,0.54605520) (0.01220465,0.41263413) (0.38418221,0.39658678) (-0.49345541,0.13574487) 26: [7,*] (0.08767700,0.27388635) (0.42689300,0.54163760) (0.42322290,0.88915259) (0.27913439,0.60699731) (-0.18934026,0.24518129) (0.38722092,0.89842355) (0.40735584,0.30166972) (-0.28098965,0.36893281) -26: TRANSFORM MOPS=6.745288e+02 5.902360e-01 +26: TRANSFORM MOPS=6.708090e+02 5.935090e-01 26: Test7 OK 26: [0,*] (-0.22755254,0.57269159) (-0.07478989,0.43807784) (-0.24730353,0.78578815) (0.20665902,0.62266508) (0.12482685,0.51164074) (0.24353600,0.92878744) (0.46334137,0.36037633) (0.46272543,0.51957551) 26: [1,*] (0.35175250,0.72459751) (-0.35089990,0.16703264) (-0.44773651,0.15582966) (0.48021385,0.80343313) (0.29902630,0.45075531) (0.49398458,0.95469289) (-0.43422229,0.44721513) (-0.32410302,0.30609395) @@ -3694,7 +4245,7 @@ 26: [5,*] (-0.11862637,0.74522584) (0.25353933,0.18655012) (0.03539079,0.30360753) (-0.30266334,0.59161415) (-0.21397802,0.62723828) (0.44885690,0.47638956) (-0.46902392,0.64435797) (-0.29529039,0.08937368) 26: [6,*] (0.06185808,0.52913210) (-0.07325087,0.09385617) (0.37951079,0.81747530) (-0.32779262,0.02006209) (0.15632005,0.08172432) (-0.32126779,0.68346498) (-0.22019094,0.41530889) (0.11700355,0.56863624) 26: [7,*] (-0.04127420,0.47510442) (-0.03989285,0.68613051) (-0.25309523,0.67283206) (-0.30727698,0.30224587) (-0.04743560,0.79662554) (0.07633570,0.91835310) (0.24781771,0.35148821) (-0.47573126,0.30066112) -26: TRANSFORM MOPS=5.830699e+02 6.828190e-01 +26: TRANSFORM MOPS=5.471187e+02 7.276870e-01 26: Test7 OK 26: 26: @@ -3702,7 +4253,7 @@ 26: 26: 26: Tensor seems vaguely OK ... fingers crossed -26/56 Test #26: tensor-oldtest .......................... Passed 2.50 sec +26/56 Test #26: tensor-oldtest .......................... Passed 4.75 sec test 27 Start 27: tensor-test_mtxmq @@ -3713,76 +4264,76 @@ 27: Starting to test ... 27: ... OK! 27: type M N K LOOP BLAS (GF/s) -27: (m*m)T*(m*m) 2 2 2 0.18 0.22 -27: (m*m)T*(m*m) 4 4 4 0.76 0.78 -27: (m*m)T*(m*m) 6 6 6 1.05 1.12 -27: (m*m)T*(m*m) 8 8 8 1.27 1.34 -27: (m*m)T*(m*m) 10 10 10 1.44 1.50 -27: (m*m)T*(m*m) 12 12 12 1.57 1.62 -27: (m*m)T*(m*m) 14 14 14 1.60 1.64 -27: (m*m)T*(m*m) 16 16 16 1.64 1.67 -27: (m*m)T*(m*m) 18 18 18 1.59 1.62 -27: (m*m)T*(m*m) 20 20 20 1.64 1.67 -27: (m*m)T*(m*m) 22 22 22 1.67 1.70 -27: (m*m)T*(m*m) 24 24 24 1.30 1.34 -27: (m*m)T*(m*m) 26 26 26 1.32 1.33 -27: (m*m)T*(m*m) 28 28 28 1.36 1.37 -27: (m*m)T*(m*m) 30 30 30 1.36 1.38 -27: (m*m)T*(m*m) 32 32 32 1.39 1.41 -27: (m*m)T*(m*m) 34 34 34 1.37 1.37 -27: (m*m)T*(m*m) 36 36 36 1.41 1.43 -27: (m*m)T*(m*m) 38 38 38 1.39 1.41 -27: (m*m)T*(m*m) 40 40 40 1.43 1.45 -27: (m*m)T*(m*m) 42 42 42 1.43 1.44 -27: (m*m)T*(m*m) 44 44 44 1.45 1.46 -27: (m*m)T*(m*m) 46 46 46 1.30 1.36 -27: (m*m)T*(m*m) 48 48 48 1.38 1.37 -27: (m*m)T*(m*m) 50 50 50 1.48 1.49 -27: (m*m)T*(m*m) 52 52 52 1.51 1.51 -27: (m*m)T*(m*m) 54 54 54 1.33 1.31 -27: (m*m)T*(m*m) 56 56 56 1.51 1.50 -27: (m*m)T*(m*m) 58 58 58 1.52 1.52 -27: (m*m,m)T*(m*m) 4 2 2 0.28 0.29 -27: (m*m,m)T*(m*m) 16 4 4 0.98 1.12 -27: (m*m,m)T*(m*m) 36 6 6 1.17 1.24 -27: (m*m,m)T*(m*m) 64 8 8 1.39 1.44 -27: (m*m,m)T*(m*m) 100 10 10 1.48 1.54 -27: (m*m,m)T*(m*m) 144 12 12 1.59 1.63 -27: (m*m,m)T*(m*m) 196 14 14 1.57 1.61 -27: (m*m,m)T*(m*m) 256 16 16 1.31 1.33 -27: (m*m,m)T*(m*m) 324 18 18 1.55 1.58 -27: (m*m,m)T*(m*m) 400 20 20 1.60 1.63 -27: (m*m,m)T*(m*m) 484 22 22 1.64 1.66 -27: (m*m,m)T*(m*m) 576 24 24 1.23 1.26 -27: (m*m,m)T*(m*m) 676 26 26 1.29 1.31 -27: (m*m,m)T*(m*m) 784 28 28 1.33 1.34 -27: (m*m,m)T*(m*m) 900 30 30 1.36 1.36 -27: tran(m,m,m) 4 2 2 0.22 0.30 -27: tran(m,m,m) 16 4 4 0.95 1.02 -27: tran(m,m,m) 36 6 6 1.16 1.05 -27: tran(m,m,m) 64 8 8 1.15 1.19 -27: tran(m,m,m) 100 10 10 1.47 1.52 -27: tran(m,m,m) 144 12 12 1.58 1.62 -27: tran(m,m,m) 196 14 14 1.57 1.56 -27: tran(m,m,m) 256 16 16 1.28 1.33 -27: tran(m,m,m) 324 18 18 1.55 1.58 -27: tran(m,m,m) 400 20 20 1.59 1.62 -27: tran(m,m,m) 484 22 22 1.64 1.63 -27: tran(m,m,m) 576 24 24 1.02 1.03 -27: tran(m,m,m) 676 26 26 1.04 1.05 -27: tran(m,m,m) 784 28 28 1.05 1.31 -27: tran(m,m,m) 900 30 30 1.32 1.33 -27: (20*20,20)T*(20,m) 400 2 20 0.65 0.66 -27: (20*20,20)T*(20,m) 400 4 20 1.24 1.12 -27: (20*20,20)T*(20,m) 400 6 20 1.41 1.48 -27: (20*20,20)T*(20,m) 400 8 20 1.26 1.48 -27: (20*20,20)T*(20,m) 400 10 20 1.52 1.56 -27: (20*20,20)T*(20,m) 400 12 20 1.60 1.66 -27: (20*20,20)T*(20,m) 400 14 20 1.58 1.59 -27: (20*20,20)T*(20,m) 400 16 20 1.59 1.60 -27: (20*20,20)T*(20,m) 400 18 20 1.50 1.53 -27: (20*20,20)T*(20,m) 400 20 20 1.55 1.58 -27/56 Test #27: tensor-test_mtxmq ....................... Passed 473.10 sec +27: (m*m)T*(m*m) 2 2 2 0.23 0.20 +27: (m*m)T*(m*m) 4 4 4 0.60 0.66 +27: (m*m)T*(m*m) 6 6 6 0.88 0.94 +27: (m*m)T*(m*m) 8 8 8 1.15 1.09 +27: (m*m)T*(m*m) 10 10 10 1.13 1.22 +27: (m*m)T*(m*m) 12 12 12 1.17 1.26 +27: (m*m)T*(m*m) 14 14 14 1.26 1.27 +27: (m*m)T*(m*m) 16 16 16 1.31 1.28 +27: (m*m)T*(m*m) 18 18 18 1.33 1.29 +27: (m*m)T*(m*m) 20 20 20 1.30 1.32 +27: (m*m)T*(m*m) 22 22 22 1.32 1.33 +27: (m*m)T*(m*m) 24 24 24 1.35 1.34 +27: (m*m)T*(m*m) 26 26 26 1.39 1.35 +27: (m*m)T*(m*m) 28 28 28 1.35 1.36 +27: (m*m)T*(m*m) 30 30 30 1.36 0.68 +27: (m*m)T*(m*m) 32 32 32 0.76 0.76 +27: (m*m)T*(m*m) 34 34 34 0.82 0.82 +27: (m*m)T*(m*m) 36 36 36 0.87 1.28 +27: (m*m)T*(m*m) 38 38 38 1.31 1.32 +27: (m*m)T*(m*m) 40 40 40 0.73 1.35 +27: (m*m)T*(m*m) 42 42 42 1.35 1.36 +27: (m*m)T*(m*m) 44 44 44 0.70 0.70 +27: (m*m)T*(m*m) 46 46 46 0.75 1.42 +27: (m*m)T*(m*m) 48 48 48 1.43 1.46 +27: (m*m)T*(m*m) 50 50 50 1.42 1.46 +27: (m*m)T*(m*m) 52 52 52 1.48 1.49 +27: (m*m)T*(m*m) 54 54 54 1.51 1.52 +27: (m*m)T*(m*m) 56 56 56 1.52 1.53 +27: (m*m)T*(m*m) 58 58 58 0.73 1.54 +27: (m*m,m)T*(m*m) 4 2 2 0.24 0.29 +27: (m*m,m)T*(m*m) 16 4 4 1.09 0.82 +27: (m*m,m)T*(m*m) 36 6 6 1.35 1.44 +27: (m*m,m)T*(m*m) 64 8 8 1.45 1.15 +27: (m*m,m)T*(m*m) 100 10 10 1.54 1.62 +27: (m*m,m)T*(m*m) 144 12 12 1.36 1.38 +27: (m*m,m)T*(m*m) 196 14 14 0.78 1.25 +27: (m*m,m)T*(m*m) 256 16 16 1.29 1.34 +27: (m*m,m)T*(m*m) 324 18 18 1.30 1.35 +27: (m*m,m)T*(m*m) 400 20 20 1.31 1.32 +27: (m*m,m)T*(m*m) 484 22 22 1.13 1.35 +27: (m*m,m)T*(m*m) 576 24 24 1.34 1.40 +27: (m*m,m)T*(m*m) 676 26 26 1.43 1.48 +27: (m*m,m)T*(m*m) 784 28 28 1.36 1.29 +27: (m*m,m)T*(m*m) 900 30 30 1.38 1.40 +27: tran(m,m,m) 4 2 2 0.22 0.29 +27: tran(m,m,m) 16 4 4 0.71 0.82 +27: tran(m,m,m) 36 6 6 0.97 1.05 +27: tran(m,m,m) 64 8 8 1.26 1.23 +27: tran(m,m,m) 100 10 10 1.18 1.22 +27: tran(m,m,m) 144 12 12 1.16 0.70 +27: tran(m,m,m) 196 14 14 0.62 1.26 +27: tran(m,m,m) 256 16 16 1.27 1.28 +27: tran(m,m,m) 324 18 18 1.29 1.30 +27: tran(m,m,m) 400 20 20 1.30 1.32 +27: tran(m,m,m) 484 22 22 1.32 1.37 +27: tran(m,m,m) 576 24 24 1.38 1.35 +27: tran(m,m,m) 676 26 26 1.33 2.30 +27: tran(m,m,m) 784 28 28 1.35 1.35 +27: tran(m,m,m) 900 30 30 1.34 0.95 +27: (20*20,20)T*(20,m) 400 2 20 0.40 0.41 +27: (20*20,20)T*(20,m) 400 4 20 0.97 0.99 +27: (20*20,20)T*(20,m) 400 6 20 1.07 1.15 +27: (20*20,20)T*(20,m) 400 8 20 1.22 1.22 +27: (20*20,20)T*(20,m) 400 10 20 0.65 0.64 +27: (20*20,20)T*(20,m) 400 12 20 1.20 1.25 +27: (20*20,20)T*(20,m) 400 14 20 1.36 1.30 +27: (20*20,20)T*(20,m) 400 16 20 1.28 1.29 +27: (20*20,20)T*(20,m) 400 18 20 1.30 1.39 +27: (20*20,20)T*(20,m) 400 20 20 1.37 1.37 +27/56 Test #27: tensor-test_mtxmq ....................... Passed 944.38 sec test 28 Start 28: tensor-jimkernel @@ -3800,17 +4351,20 @@ 28: doing box 70 28: doing box 80 28: doing box 90 -28: used 57.1103 s nflop 8.262e+10 rate 1.44667e+09 -28/56 Test #28: tensor-jimkernel ........................ Passed 57.17 sec +28: used 145.406 s nflop 8.262e+10 rate 5.68203e+08 +28/56 Test #28: tensor-jimkernel ........................ Passed 145.49 sec test 29 Start 29: tensor-test_distributed_matrix 29: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor/test_distributed_matrix 29: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor 29: Test timeout computed to be: 1500 -29: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +29: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 29: MADNESS runtime finalized but 1 world still exists -29/56 Test #29: tensor-test_distributed_matrix .......... Passed 0.49 sec +29/56 Test #29: tensor-test_distributed_matrix ..........***Timeout 1500.21 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +MADNESS runtime finalized but 1 world still exists + test 30 Start 30: tensor-test_Zmtxmq @@ -3821,124 +4375,126 @@ 30: Starting to test ... 30: ... OK! 30: type M N K LOOP BLAS (GF/s) -30: (m*m)T*(m*m) 2 2 2 inf 0.00 -30: (m*m)T*(m*m) 4 4 4 inf 0.00 -30: (m*m)T*(m*m) 6 6 6 0.83 0.00 -30: (m*m)T*(m*m) 8 8 8 0.69 0.00 -30: (m*m)T*(m*m) 10 10 10 0.75 0.00 -30: (m*m)T*(m*m) 12 12 12 0.82 0.00 -30: (m*m)T*(m*m) 14 14 14 0.71 0.00 -30: (m*m)T*(m*m) 16 16 16 0.73 0.00 -30: (m*m)T*(m*m) 18 18 18 0.72 0.00 -30: (m*m)T*(m*m) 20 20 20 0.74 0.00 -30: (m*m)T*(m*m) 22 22 22 0.73 0.00 -30: (m*m)T*(m*m) 24 24 24 0.63 0.00 -30: (m*m)T*(m*m) 26 26 26 0.61 0.00 -30: (m*m)T*(m*m) 28 28 28 0.62 0.00 -30: (m*m)T*(m*m) 30 30 30 0.57 0.00 -30: (m*m)T*(m*m) 32 32 32 0.53 0.00 -30: (m*m)T*(m*m) 34 34 34 0.54 0.00 -30: (m*m)T*(m*m) 36 36 36 0.55 0.00 -30: (m*m)T*(m*m) 38 38 38 0.56 0.00 -30: (m*m)T*(m*m) 40 40 40 0.58 0.00 -30: (m*m)T*(m*m) 42 42 42 0.67 0.00 -30: (m*m)T*(m*m) 44 44 44 0.68 0.00 -30: (m*m)T*(m*m) 46 46 46 0.67 0.00 -30: (m*m)T*(m*m) 48 48 48 0.68 0.00 -30: (m*m)T*(m*m) 50 50 50 0.69 0.00 -30: (m*m)T*(m*m) 52 52 52 0.69 0.00 -30: (m*m)T*(m*m) 54 54 54 0.69 0.00 -30: (m*m)T*(m*m) 56 56 56 0.68 0.00 -30: (m*m)T*(m*m) 58 58 58 0.66 0.00 -30: (m*m,m)T*(m*m) 1 1 1 inf 0.00 -30: (m*m,m)T*(m*m) 4 2 2 inf 0.00 -30: (m*m,m)T*(m*m) 9 3 3 inf 0.00 -30: (m*m,m)T*(m*m) 16 4 4 1.37 0.00 -30: (m*m,m)T*(m*m) 25 5 5 0.74 0.00 -30: (m*m,m)T*(m*m) 36 6 6 0.71 0.00 -30: (m*m,m)T*(m*m) 49 7 7 0.57 0.00 -30: (m*m,m)T*(m*m) 64 8 8 0.56 0.00 -30: (m*m,m)T*(m*m) 81 9 9 0.59 0.00 -30: (m*m,m)T*(m*m) 100 10 10 0.61 0.00 -30: (m*m,m)T*(m*m) 121 11 11 0.62 0.00 -30: (m*m,m)T*(m*m) 144 12 12 0.66 0.00 -30: (m*m,m)T*(m*m) 169 13 13 0.68 0.00 -30: (m*m,m)T*(m*m) 196 14 14 0.65 0.00 -30: (m*m,m)T*(m*m) 225 15 15 0.65 0.00 -30: (m*m,m)T*(m*m) 256 16 16 0.61 0.00 -30: (m*m,m)T*(m*m) 289 17 17 0.67 0.00 -30: (m*m,m)T*(m*m) 324 18 18 0.68 0.00 -30: (m*m,m)T*(m*m) 361 19 19 0.68 0.00 -30: (m*m,m)T*(m*m) 400 20 20 0.68 0.00 -30: (m*m,m)T*(m*m) 441 21 21 0.69 0.00 -30: (m*m,m)T*(m*m) 484 22 22 0.66 0.00 -30: (m*m,m)T*(m*m) 529 23 23 0.68 0.00 -30: (m*m,m)T*(m*m) 576 24 24 0.58 0.00 -30: (m*m,m)T*(m*m) 625 25 25 0.61 0.00 -30: (m*m,m)T*(m*m) 676 26 26 0.59 0.00 -30: (m*m,m)T*(m*m) 729 27 27 0.62 0.00 -30: (m*m,m)T*(m*m) 784 28 28 0.61 0.00 -30: (m*m,m)T*(m*m) 841 29 29 0.61 0.00 -30: (m*m,m)T*(m*m) 900 30 30 0.62 0.00 -30: tran(m,m,m) 1 1 1 inf 0.00 -30: tran(m,m,m) 4 2 2 inf 0.00 -30: tran(m,m,m) 9 3 3 1.01 0.00 -30: tran(m,m,m) 16 4 4 0.71 0.00 -30: tran(m,m,m) 25 5 5 0.60 0.00 -30: tran(m,m,m) 36 6 6 0.61 0.00 -30: tran(m,m,m) 49 7 7 0.53 0.00 -30: tran(m,m,m) 64 8 8 0.58 0.00 -30: tran(m,m,m) 81 9 9 0.60 0.00 -30: tran(m,m,m) 100 10 10 0.60 0.00 -30: tran(m,m,m) 121 11 11 0.64 0.00 -30: tran(m,m,m) 144 12 12 0.67 0.00 -30: tran(m,m,m) 169 13 13 0.69 0.00 -30: tran(m,m,m) 196 14 14 0.66 0.00 -30: tran(m,m,m) 225 15 15 0.65 0.00 -30: tran(m,m,m) 256 16 16 0.60 0.00 -30: tran(m,m,m) 289 17 17 0.66 0.00 -30: tran(m,m,m) 324 18 18 0.67 0.00 -30: tran(m,m,m) 361 19 19 0.67 0.00 -30: tran(m,m,m) 400 20 20 0.69 0.00 -30: tran(m,m,m) 441 21 21 0.70 0.00 -30: tran(m,m,m) 484 22 22 0.69 0.00 -30: tran(m,m,m) 529 23 23 0.68 0.00 -30: tran(m,m,m) 576 24 24 0.57 0.00 -30: tran(m,m,m) 625 25 25 0.60 0.00 -30: tran(m,m,m) 676 26 26 0.60 0.00 -30: tran(m,m,m) 729 27 27 0.58 0.00 -30: tran(m,m,m) 784 28 28 0.58 0.00 -30: tran(m,m,m) 841 29 29 0.60 0.00 -30: tran(m,m,m) 900 30 30 0.61 0.00 -30: (20*20,20)T*(20,m) 400 1 20 0.30 0.00 -30: (20*20,20)T*(20,m) 400 2 20 0.42 0.00 -30: (20*20,20)T*(20,m) 400 3 20 0.46 0.00 -30: (20*20,20)T*(20,m) 400 4 20 0.55 0.00 -30: (20*20,20)T*(20,m) 400 5 20 0.58 0.00 -30: (20*20,20)T*(20,m) 400 6 20 0.62 0.00 -30: (20*20,20)T*(20,m) 400 7 20 0.52 0.00 -30: (20*20,20)T*(20,m) 400 8 20 0.52 0.00 -30: (20*20,20)T*(20,m) 400 9 20 0.53 0.00 -30: (20*20,20)T*(20,m) 400 10 20 0.55 0.00 -30: (20*20,20)T*(20,m) 400 11 20 0.56 0.00 -30: (20*20,20)T*(20,m) 400 12 20 0.59 0.00 -30: (20*20,20)T*(20,m) 400 13 20 0.56 0.00 -30: (20*20,20)T*(20,m) 400 14 20 0.56 0.00 -30: (20*20,20)T*(20,m) 400 15 20 0.55 0.00 -30: (20*20,20)T*(20,m) 400 16 20 0.56 0.00 -30: (20*20,20)T*(20,m) 400 17 20 0.57 0.00 -30: (20*20,20)T*(20,m) 400 18 20 0.57 0.00 -30: (20*20,20)T*(20,m) 400 19 20 0.57 0.00 -30: (20*20,20)T*(20,m) 400 20 20 0.58 0.00 -30/56 Test #30: tensor-test_Zmtxmq ...................... Passed 29.45 sec +30: (m*m)T*(m*m) 2 2 2 0.13 0.00 +30: (m*m)T*(m*m) 4 4 4 0.38 0.00 +30: (m*m)T*(m*m) 6 6 6 0.57 0.00 +30: (m*m)T*(m*m) 8 8 8 0.62 0.00 +30: (m*m)T*(m*m) 10 10 10 0.66 0.00 +30: (m*m)T*(m*m) 12 12 12 0.65 0.00 +30: (m*m)T*(m*m) 14 14 14 0.52 0.00 +30: (m*m)T*(m*m) 16 16 16 0.60 0.00 +30: (m*m)T*(m*m) 18 18 18 0.54 0.00 +30: (m*m)T*(m*m) 20 20 20 0.69 0.00 +30: (m*m)T*(m*m) 22 22 22 0.14 0.00 +30: (m*m)T*(m*m) 24 24 24 0.13 0.00 +30: (m*m)T*(m*m) 26 26 26 0.20 0.00 +30: (m*m)T*(m*m) 28 28 28 0.14 0.00 +30: (m*m)T*(m*m) 30 30 30 0.12 0.00 +30: (m*m)T*(m*m) 32 32 32 0.17 0.00 +30: (m*m)T*(m*m) 34 34 34 0.14 0.00 +30: (m*m)T*(m*m) 36 36 36 0.17 0.00 +30: (m*m)T*(m*m) 38 38 38 0.17 0.00 +30: (m*m)T*(m*m) 40 40 40 0.16 0.00 +30: (m*m)T*(m*m) 42 42 42 0.16 0.00 +30: (m*m)T*(m*m) 44 44 44 0.15 0.00 +30: (m*m)T*(m*m) 46 46 46 0.16 0.00 +30: (m*m)T*(m*m) 48 48 48 0.16 0.00 +30: (m*m)T*(m*m) 50 50 50 0.16 0.00 +30: (m*m)T*(m*m) 52 52 52 0.16 0.00 +30: (m*m)T*(m*m) 54 54 54 0.15 0.00 +30: (m*m)T*(m*m) 56 56 56 0.16 0.00 +30: (m*m)T*(m*m) 58 58 58 0.14 0.00 +30: (m*m,m)T*(m*m) 1 1 1 0.03 0.00 +30: (m*m,m)T*(m*m) 4 2 2 0.22 0.00 +30: (m*m,m)T*(m*m) 9 3 3 0.45 0.00 +30: (m*m,m)T*(m*m) 16 4 4 0.52 0.00 +30: (m*m,m)T*(m*m) 25 5 5 0.51 0.00 +30: (m*m,m)T*(m*m) 36 6 6 0.60 0.00 +30: (m*m,m)T*(m*m) 49 7 7 0.61 0.00 +30: (m*m,m)T*(m*m) 64 8 8 0.69 0.00 +30: (m*m,m)T*(m*m) 81 9 9 0.67 0.00 +30: (m*m,m)T*(m*m) 100 10 10 0.63 0.00 +30: (m*m,m)T*(m*m) 121 11 11 0.22 0.00 +30: (m*m,m)T*(m*m) 144 12 12 0.27 0.00 +30: (m*m,m)T*(m*m) 169 13 13 0.22 0.00 +30: (m*m,m)T*(m*m) 196 14 14 0.16 0.00 +30: (m*m,m)T*(m*m) 225 15 15 0.17 0.00 +30: (m*m,m)T*(m*m) 256 16 16 0.14 0.00 +30: (m*m,m)T*(m*m) 289 17 17 0.16 0.00 +30: (m*m,m)T*(m*m) 324 18 18 0.22 0.00 +30: (m*m,m)T*(m*m) 361 19 19 0.22 0.00 +30: (m*m,m)T*(m*m) 400 20 20 0.21 0.00 +30: (m*m,m)T*(m*m) 441 21 21 0.19 0.00 +30: (m*m,m)T*(m*m) 484 22 22 0.20 0.00 +30: (m*m,m)T*(m*m) 529 23 23 0.25 0.00 +30: (m*m,m)T*(m*m) 576 24 24 0.48 0.00 +30: (m*m,m)T*(m*m) 625 25 25 0.59 0.00 +30: (m*m,m)T*(m*m) 676 26 26 0.20 0.00 +30: (m*m,m)T*(m*m) 729 27 27 0.65 0.00 +30: (m*m,m)T*(m*m) 784 28 28 0.56 0.00 +30: (m*m,m)T*(m*m) 841 29 29 0.64 0.00 +30: (m*m,m)T*(m*m) 900 30 30 0.19 0.00 +30: tran(m,m,m) 1 1 1 0.02 0.00 +30: tran(m,m,m) 4 2 2 0.21 0.00 +30: tran(m,m,m) 9 3 3 0.40 0.00 +30: tran(m,m,m) 16 4 4 0.40 0.00 +30: tran(m,m,m) 25 5 5 0.55 0.00 +30: tran(m,m,m) 36 6 6 0.57 0.00 +30: tran(m,m,m) 49 7 7 0.57 0.00 +30: tran(m,m,m) 64 8 8 0.28 0.00 +30: tran(m,m,m) 81 9 9 0.28 0.00 +30: tran(m,m,m) 100 10 10 0.32 0.00 +30: tran(m,m,m) 121 11 11 0.25 0.00 +30: tran(m,m,m) 144 12 12 0.20 0.00 +30: tran(m,m,m) 169 13 13 0.24 0.00 +30: tran(m,m,m) 196 14 14 0.24 0.00 +30: tran(m,m,m) 225 15 15 0.23 0.00 +30: tran(m,m,m) 256 16 16 0.44 0.00 +30: tran(m,m,m) 289 17 17 0.40 0.00 +30: tran(m,m,m) 324 18 18 0.22 0.00 +30: tran(m,m,m) 361 19 19 0.21 0.00 +30: tran(m,m,m) 400 20 20 0.24 0.00 +30: tran(m,m,m) 441 21 21 0.38 0.00 +30: tran(m,m,m) 484 22 22 0.21 0.00 +30: tran(m,m,m) 529 23 23 0.53 0.00 +30: tran(m,m,m) 576 24 24 0.44 0.00 +30: tran(m,m,m) 625 25 25 0.42 0.00 +30: tran(m,m,m) 676 26 26 0.36 0.00 +30: tran(m,m,m) 729 27 27 0.33 0.00 +30: tran(m,m,m) 784 28 28 0.33 0.00 +30: tran(m,m,m) 841 29 29 0.36 0.00 +30: tran(m,m,m) 900 30 30 0.28 0.00 +30: (20*20,20)T*(20,m) 400 1 20 0.17 0.00 +30: (20*20,20)T*(20,m) 400 2 20 0.19 0.00 +30: (20*20,20)T*(20,m) 400 3 20 0.25 0.00 +30: (20*20,20)T*(20,m) 400 4 20 0.24 0.00 +30: (20*20,20)T*(20,m) 400 5 20 0.22 0.00 +30: (20*20,20)T*(20,m) 400 6 20 0.22 0.00 +30: (20*20,20)T*(20,m) 400 7 20 0.24 0.00 +30: (20*20,20)T*(20,m) 400 8 20 0.22 0.00 +30: (20*20,20)T*(20,m) 400 9 20 0.24 0.00 +30: (20*20,20)T*(20,m) 400 10 20 0.24 0.00 +30: (20*20,20)T*(20,m) 400 11 20 0.24 0.00 +30: (20*20,20)T*(20,m) 400 12 20 0.24 0.00 +30: (20*20,20)T*(20,m) 400 13 20 0.25 0.00 +30: (20*20,20)T*(20,m) 400 14 20 0.25 0.00 +30: (20*20,20)T*(20,m) 400 15 20 0.24 0.00 +30: (20*20,20)T*(20,m) 400 16 20 0.24 0.00 +30: (20*20,20)T*(20,m) 400 17 20 0.25 0.00 +30: (20*20,20)T*(20,m) 400 18 20 0.24 0.00 +30: (20*20,20)T*(20,m) 400 19 20 0.24 0.00 +30: (20*20,20)T*(20,m) 400 20 20 0.25 0.00 +30/56 Test #30: tensor-test_Zmtxmq ...................... Passed 74.49 sec test 31 Start 31: tensor-test_systolic 31: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor/test_systolic 31: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor 31: Test timeout computed to be: 1500 -31: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 -31/56 Test #31: tensor-test_systolic .................... Passed 544.49 sec +31: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +31/56 Test #31: tensor-test_systolic ....................***Timeout 1500.14 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 + test 32 Start 32: build_linalg_unittests @@ -4095,7 +4651,7 @@ 32: gmake[4]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 32: gmake[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 32: -32/56 Test #32: build_linalg_unittests .................. Passed 10.33 sec +32/56 Test #32: build_linalg_unittests .................. Passed 10.83 sec test 33 Start 33: linalg-test_linalg @@ -4190,7 +4746,7 @@ 33: error in double inverse 8.92867e-17 33: 33: Test passed -33/56 Test #33: linalg-test_linalg ...................... Passed 0.17 sec +33/56 Test #33: linalg-test_linalg ...................... Passed 0.24 sec test 34 Start 34: linalg-test_solvers @@ -4247,7 +4803,7 @@ 35: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/tensor 35: Test timeout computed to be: 1500 35: no testseprep without having a GenTensor -35/56 Test #35: linalg-testseprep ....................... Passed 0.00 sec +35/56 Test #35: linalg-testseprep ....................... Passed 0.01 sec test 36 Start 36: build_mra_unittests @@ -4554,129 +5110,220 @@ 36: gmake[4]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 36: gmake[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 36: -36/56 Test #36: build_mra_unittests ..................... Passed 283.13 sec +36/56 Test #36: build_mra_unittests ..................... Passed 290.72 sec test 37 Start 37: mra-testbsh 37: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testbsh 37: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra 37: Test timeout computed to be: 1500 -37: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +37: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 37: small test : false 37: Test BSH operation, type = double , ndim = 3 37: 37: Testing with k 4 37: norm and error of the initial function 1.000000e+00 1.441089e-06 37: applying - 1 -37: done in time 3.10855606e+01 +37: done in time 3.38229902e+01 37: err in opf 2.71464707e-06 37: err in f 1.44108881e-06 37: 37: Testing with k 5 37: norm and error of the initial function 9.99999999e-01 1.01716732e-06 37: applying - 1 -37: done in time 7.95257039e+00 +37: done in time 7.88048023e+00 37: err in opf 1.55962596e-06 37: err in f 1.01716732e-06 37: 37: Testing with k 6 37: norm and error of the initial function 1.00000000e+00 7.36373004e-07 37: applying - 1 -37: done in time 3.12075705e+00 +37: done in time 3.53454234e+00 37: err in opf 9.17120564e-07 37: err in f 7.36373004e-07 37: 37: Testing with k 7 37: norm and error of the initial function 1.00000000e+00 5.47334788e-07 37: applying - 1 -37: done in time 1.95717786e+00 +37: done in time 2.32760739e+00 37: err in opf 4.29167451e-07 37: err in f 5.47334788e-07 37: 37: Testing with k 8 37: norm and error of the initial function 1.00000000e+00 4.37286479e-07 37: applying - 1 -37: done in time 2.04135417e+00 +37: done in time 2.24346574e+00 37: err in opf 1.37569639e-07 37: err in f 4.37286479e-07 37: 37: Testing with k 9 37: norm and error of the initial function 1.00000000e+00 3.30281565e-07 37: applying - 1 -37: done in time 1.83257699e+00 +37: done in time 2.42946333e+00 37: err in opf 1.07046882e-07 37: err in f 3.30281565e-07 37: 37: Testing with k 10 37: norm and error of the initial function 1.00000000e+00 8.76802295e-08 37: applying - 1 -37: done in time 2.43350636e+00 +37: done in time 2.89272193e+00 37: err in opf 1.42134490e-07 37: err in f 8.76802295e-08 37: 37: Testing with k 11 37: norm and error of the initial function 1.00000000e+00 2.47068208e-07 37: applying - 1 -37: done in time 3.36700771e+00 +37: done in time 3.73405408e+00 37: err in opf 1.33749018e-07 37: err in f 2.47068208e-07 37: 37: Testing with k 12 37: norm and error of the initial function 1.00000000e+00 6.84994563e-08 37: applying - 1 -37: done in time 4.76324263e+00 +37: done in time 5.25927329e+00 37: err in opf 7.32280643e-08 37: err in f 6.84994563e-08 37: MADNESS runtime finalized but 1 world still exists -37/56 Test #37: mra-testbsh ............................. Passed 152.51 sec +37/56 Test #37: mra-testbsh .............................***Timeout 1500.12 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +small test : false +Test BSH operation, type = double , ndim = 3 + + Testing with k 4 +norm and error of the initial function 1.000000e+00 1.441089e-06 +applying - 1 +done in time 3.38229902e+01 +err in opf 2.71464707e-06 +err in f 1.44108881e-06 + + Testing with k 5 +norm and error of the initial function 9.99999999e-01 1.01716732e-06 +applying - 1 +done in time 7.88048023e+00 +err in opf 1.55962596e-06 +err in f 1.01716732e-06 + + Testing with k 6 +norm and error of the initial function 1.00000000e+00 7.36373004e-07 +applying - 1 +done in time 3.53454234e+00 +err in opf 9.17120564e-07 +err in f 7.36373004e-07 + + Testing with k 7 +norm and error of the initial function 1.00000000e+00 5.47334788e-07 +applying - 1 +done in time 2.32760739e+00 +err in opf 4.29167451e-07 +err in f 5.47334788e-07 + + Testing with k 8 +norm and error of the initial function 1.00000000e+00 4.37286479e-07 +applying - 1 +done in time 2.24346574e+00 +err in opf 1.37569639e-07 +err in f 4.37286479e-07 + + Testing with k 9 +norm and error of the initial function 1.00000000e+00 3.30281565e-07 +applying - 1 +done in time 2.42946333e+00 +err in opf 1.07046882e-07 +err in f 3.30281565e-07 + + Testing with k 10 +norm and error of the initial function 1.00000000e+00 8.76802295e-08 +applying - 1 +done in time 2.89272193e+00 +err in opf 1.42134490e-07 +err in f 8.76802295e-08 + + Testing with k 11 +norm and error of the initial function 1.00000000e+00 2.47068208e-07 +applying - 1 +done in time 3.73405408e+00 +err in opf 1.33749018e-07 +err in f 2.47068208e-07 + + Testing with k 12 +norm and error of the initial function 1.00000000e+00 6.84994563e-08 +applying - 1 +done in time 5.25927329e+00 +err in opf 7.32280643e-08 +err in f 6.84994563e-08 +MADNESS runtime finalized but 1 world still exists + test 38 Start 38: mra-testproj 38: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testproj 38: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra 38: Test timeout computed to be: 1500 -38: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +38: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 38: small test : true 38: I think the cell volume is 8.00000000e+00 38: L 4.00000000e+00 3.18309886e+01 6.35777509e+01 3 11 -38: error in 1 dimensions 3.89132988e-10 +38: error in 1 dimensions 3.89132985e-10 38: I think the cell volume is 6.40000000e+01 38: L 4.00000000e+00 5.64189584e+00 2.25079079e+01 557 10 -38: error in 2 dimensions 2.81635700e-09 +38: error in 2 dimensions 2.81594935e-09 38: MADNESS runtime finalized but 1 world still exists -38/56 Test #38: mra-testproj ............................ Passed 2.89 sec +38/56 Test #38: mra-testproj ............................***Timeout 1500.12 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +small test : true +I think the cell volume is 8.00000000e+00 +L 4.00000000e+00 3.18309886e+01 6.35777509e+01 3 11 +error in 1 dimensions 3.89132985e-10 +I think the cell volume is 6.40000000e+01 +L 4.00000000e+00 5.64189584e+00 2.25079079e+01 557 10 +error in 2 dimensions 2.81594935e-09 +MADNESS runtime finalized but 1 world still exists + test 39 Start 39: mra-testpdiff 39: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testpdiff 39: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra 39: Test timeout computed to be: 1500 -39: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +39: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 39: 0 error 2.997260e-05 39: 1 error 2.997260e-05 39: 2 error 2.997260e-05 39: MADNESS runtime finalized but 1 world still exists -39/56 Test #39: mra-testpdiff ........................... Passed 2.01 sec +39/56 Test #39: mra-testpdiff ...........................***Timeout 1500.12 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +0 error 2.997260e-05 +1 error 2.997260e-05 +2 error 2.997260e-05 +MADNESS runtime finalized but 1 world still exists + test 40 Start 40: mra-testdiff1Db 40: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testdiff1Db 40: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra 40: Test timeout computed to be: 1500 -40: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +40: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 40: Error in du1: 3.44763e-09 PASSED 40: Error in du2: 3.98564e-09 PASSED 40: Error in du3: 3.53212e-09 PASSED 40: Error in du4: 3.98564e-09 PASSED 40: MADNESS runtime finalized but 1 world still exists -40/56 Test #40: mra-testdiff1Db ......................... Passed 2.35 sec +40/56 Test #40: mra-testdiff1Db .........................***Timeout 1500.11 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +Error in du1: 3.44763e-09 PASSED +Error in du2: 3.98564e-09 PASSED +Error in du3: 3.53212e-09 PASSED +Error in du4: 3.98564e-09 PASSED +MADNESS runtime finalized but 1 world still exists + test 41 Start 41: mra-testgconv 41: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testgconv 41: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra 41: Test timeout computed to be: 1500 -41: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +41: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 41: threshold 1.000000e-06 41: polynomial 10 41: @@ -4698,14 +5345,37 @@ 41: success 6a 0 41: success 6b 0 41: MADNESS runtime finalized but 1 world still exists -41/56 Test #41: mra-testgconv ........................... Passed 2.33 sec +41/56 Test #41: mra-testgconv ...........................***Timeout 1500.12 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 + threshold 1.000000e-06 + polynomial 10 + +Test gconv operation +error in integral(g) -1.110223e-16 +success 0 0 +error in integral(op(g)) -2.699802e-08 +success 1 0 +norm2(g conv g - exact) 2.918238e-07 +success 2 0 +error in integral(h) 3.166036e-18 +success 3 0 +error in norm2(h) -5.504486e-13 +success 4 0 +norm2(g conv h - exact) 8.813232e-07 +success 5 0 +norm2(conv' g - exact) 3.609134e-07 +norm2(conv g' - exact) 3.515971e-07 +success 6a 0 +success 6b 0 +MADNESS runtime finalized but 1 world still exists + test 42 Start 42: mra-testopdir 42: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testopdir 42: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra 42: Test timeout computed to be: 1500 -42: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +42: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 42: small test : false 42: Test different operations in different dirs 42: norm of initial function 1.000000e+00 1.389196e-06 @@ -4741,14 +5411,51 @@ 42: 1 1.018302e-05 PASS 42: 2 6.559646e-06 PASS 42: MADNESS runtime finalized but 1 world still exists -42/56 Test #42: mra-testopdir ........................... Passed 70.88 sec +42/56 Test #42: mra-testopdir ...........................***Timeout 1500.18 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +small test : false +Test different operations in different dirs +norm of initial function 1.000000e+00 1.389196e-06 +m = [0,0,0] , norm = 2.240451e-01 , norm exact = 2.240449e-01 , err = 1.935514e-06 PASS +m = [0,0,1] , norm = 2.095751e-01 , norm exact = 2.095748e-01 , err = 2.583104e-06 PASS +m = [0,0,2] , norm = 3.395504e-01 , norm exact = 3.395500e-01 , err = 1.042004e-05 PASS +m = [0,1,0] , norm = 2.074255e-01 , norm exact = 2.074253e-01 , err = 1.826061e-06 PASS +m = [0,1,1] , norm = 1.940289e-01 , norm exact = 1.940286e-01 , err = 3.093914e-06 PASS +m = [0,1,2] , norm = 3.143620e-01 , norm exact = 3.143623e-01 , err = 9.464513e-06 PASS +m = [0,2,0] , norm = 3.326204e-01 , norm exact = 3.326204e-01 , err = 5.530054e-06 PASS +m = [0,2,1] , norm = 3.111380e-01 , norm exact = 3.111379e-01 , err = 6.200782e-06 PASS +m = [0,2,2] , norm = 5.041014e-01 , norm exact = 5.041011e-01 , err = 1.902422e-05 PASS +m = [1,0,0] , norm = 2.045242e-01 , norm exact = 2.045241e-01 , err = 2.362870e-06 PASS +m = [1,0,1] , norm = 1.913148e-01 , norm exact = 1.913148e-01 , err = 2.045427e-06 PASS +m = [1,0,2] , norm = 3.099656e-01 , norm exact = 3.099654e-01 , err = 9.195837e-06 PASS +m = [1,1,0] , norm = 1.893524e-01 , norm exact = 1.893525e-01 , err = 9.720014e-07 PASS +m = [1,1,1] , norm = 1.771233e-01 , norm exact = 1.771231e-01 , err = 2.320932e-06 PASS +m = [1,1,2] , norm = 2.869723e-01 , norm exact = 2.869722e-01 , err = 9.198204e-06 PASS +m = [1,2,0] , norm = 3.036396e-01 , norm exact = 3.036395e-01 , err = 6.554050e-06 PASS +m = [1,2,1] , norm = 2.840286e-01 , norm exact = 2.840288e-01 , err = 7.551762e-06 PASS +m = [1,2,2] , norm = 4.601790e-01 , norm exact = 4.601792e-01 , err = 2.060616e-05 PASS +m = [2,0,0] , norm = 3.233810e-01 , norm exact = 3.233810e-01 , err = 5.711666e-07 PASS +m = [2,0,1] , norm = 3.024952e-01 , norm exact = 3.024952e-01 , err = 3.345299e-06 PASS +m = [2,0,2] , norm = 4.900982e-01 , norm exact = 4.900983e-01 , err = 1.489803e-05 PASS +m = [2,1,0] , norm = 2.993926e-01 , norm exact = 2.993926e-01 , err = 2.092183e-06 PASS +m = [2,1,1] , norm = 2.800560e-01 , norm exact = 2.800562e-01 , err = 4.392962e-06 PASS +m = [2,1,2] , norm = 4.537430e-01 , norm exact = 4.537428e-01 , err = 1.656676e-05 PASS +m = [2,2,0] , norm = 4.800964e-01 , norm exact = 4.800963e-01 , err = 1.756093e-05 PASS +m = [2,2,1] , norm = 4.490889e-01 , norm exact = 4.490889e-01 , err = 1.826873e-05 PASS +m = [2,2,2] , norm = 7.276074e-01 , norm exact = 7.276072e-01 , err = 4.870744e-05 PASS +err in Q -8.992806e-15 +0 9.351799e-06 PASS +1 1.018302e-05 PASS +2 6.559646e-06 PASS +MADNESS runtime finalized but 1 world still exists + test 43 Start 43: mra-testinnerext 43: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testinnerext 43: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra 43: Test timeout computed to be: 1500 -43: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +43: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 43: small test : false 43: *************************************************************************** 43: alpha is a highly oscillatory function (x^2 sin(x^2)). @@ -4757,16 +5464,16 @@ 43: the numerical basis is not included. We see that since beta 43: is a simple Gaussian, it is cheaper to use the inner() method. 43: -43: timer: 1. < a | b >) 1.54s 1.54s -43: timer: 3. < a | b_ffi > -187698.82s 1.30s +43: timer: 1. < a | b >) 1.26s 1.26s +43: timer: 3. < a | b_ffi > 1.22s 1.22s 43: 43: *************************************************************************** 43: For the next two timers, the cost of computing beta in 43: the numerical basis is not included. We see that since alpha 43: is complicated, it is cheaper to use the inner_ext() method. 43: -43: timer: 4. < b | a > 187703.42s 3.30s -43: timer: 6. < b | a_ffi > 0.44s 0.44s +43: timer: 4. < b | a > 2.86s 2.86s +43: timer: 6. < b | a_ffi > 0.58s 0.58s 43: 43: Test for correctness 43: *************************************************************************** @@ -4788,14 +5495,55 @@ 43: (using inner_ext() with FunctionFunctor Interface) = 32575.6066406312 43: *************************************************************************** 43: MADNESS runtime finalized but 1 world still exists -43/56 Test #43: mra-testinnerext ........................ Passed 18.78 sec +43/56 Test #43: mra-testinnerext ........................***Timeout 1500.17 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +small test : false +*************************************************************************** +alpha is a highly oscillatory function (x^2 sin(x^2)). +beta is a pretty boring Gaussian. +For the first two timers, the cost of computing alpha in +the numerical basis is not included. We see that since beta +is a simple Gaussian, it is cheaper to use the inner() method. + +timer: 1. < a | b >) 1.26s 1.26s +timer: 3. < a | b_ffi > 1.22s 1.22s + +*************************************************************************** +For the next two timers, the cost of computing beta in +the numerical basis is not included. We see that since alpha +is complicated, it is cheaper to use the inner_ext() method. + +timer: 4. < b | a > 2.86s 2.86s +timer: 6. < b | a_ffi > 0.58s 0.58s + +Test for correctness +*************************************************************************** + (using inner() with Function) = 32572.3622504952 + (using inner_ext() with FunctionFunctor Interface) = 32572.3622504952 +*************************************************************************** + (using inner() with Function) = 1.9687012432 + (using inner_ext() with FunctionFunctor Interface) = 1.9687012432 +*************************************************************************** + (using inner() with Function) = 3.2443901360 + (using inner_ext() with FunctionFunctor Interface) = 3.2443901360 + (using inner() with Function) = 3.2443901360 + (using inner_ext() with FunctionFunctor Interface) = 3.2443901360 +*************************************************************************** + +Check that inner_ext works for Function that lacks a functor +*************************************************************************** + (using inner() with Function) = 32575.6066406311 + (using inner_ext() with FunctionFunctor Interface) = 32575.6066406312 +*************************************************************************** +MADNESS runtime finalized but 1 world still exists + test 44 Start 44: mra-testgaxpyext 44: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testgaxpyext 44: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra 44: Test timeout computed to be: 1500 -44: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +44: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 44: small test : false 44: *************************************************************************** 44: alpha is a highly oscillatory function (x^2 sin(x^2)). @@ -4803,16 +5551,16 @@ 44: For the first two timers, the cost of computing alpha in 44: the numerical basis is not included. 44: -44: timer: 1. alpha + beta 0.00s 2.40s -44: timer: 2. alpha + beta_func 0.00s 3.80s +44: timer: 1. alpha + beta 2.23s 2.23s +44: timer: 2. alpha + beta_func 6.63s 6.63s 44: *************************************************************************** 44: alpha is a highly oscillatory function (x^2 sin(x^2)). 44: beta is a pretty boring Gaussian. 44: For the next two timers, the cost of computing beta in 44: the numerical basis is not included. 44: -44: timer: 3. beta + alpha -0.00s 4.98s -44: timer: 4. beta + alpha_func 0.00s 3.82s +44: timer: 3. beta + alpha 4.49s 4.49s +44: timer: 4. beta + alpha_func 4.26s 4.26s 44: *************************************************************************** 44: Test for correctness by comparing the 2-norms. 44: (1) norm of apb = 180.4767147248537924 @@ -4820,80 +5568,234 @@ 44: (3) norm of apb = 180.4767147248537924 44: (4) norm of apb_ext = 180.4767147248545598 44: MADNESS runtime finalized but 1 world still exists -44/56 Test #44: mra-testgaxpyext ........................ Passed 22.97 sec +44/56 Test #44: mra-testgaxpyext ........................***Timeout 1500.15 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +small test : false +*************************************************************************** +alpha is a highly oscillatory function (x^2 sin(x^2)). +beta is a pretty boring Gaussian. +For the first two timers, the cost of computing alpha in +the numerical basis is not included. + +timer: 1. alpha + beta 2.23s 2.23s +timer: 2. alpha + beta_func 6.63s 6.63s +*************************************************************************** +alpha is a highly oscillatory function (x^2 sin(x^2)). +beta is a pretty boring Gaussian. +For the next two timers, the cost of computing beta in +the numerical basis is not included. + +timer: 3. beta + alpha 4.49s 4.49s +timer: 4. beta + alpha_func 4.26s 4.26s +*************************************************************************** +Test for correctness by comparing the 2-norms. +(1) norm of apb = 180.4767147248537924 +(2) norm of apb_ext = 180.4767147248540198 +(3) norm of apb = 180.4767147248537924 +(4) norm of apb_ext = 180.4767147248545598 +MADNESS runtime finalized but 1 world still exists + test 45 Start 45: mra-testvmra 45: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra 45: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra 45: Test timeout computed to be: 1500 -45: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +45: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 45: small test : 0 -45: !!MADNESS: Hung queue? -45: !!MADNESS: Hung queue? -45: !!MADNESS: Hung queue? -45: !!MADNESS: Hung queue? -45: !!MADNESS: Hung queue? -45: !!MADNESS ERROR: Exception thrown in WorldTaskQueue::fence() with 8 pending task(s) +45: errors in add 3.704781e-06 3.704781e-06 3.704781e-06 4.167008e-06 4.167008e-06 4.167008e-06 +45: errors in add 3.704781e-06 3.704781e-06 3.704781e-06 4.167008e-06 4.167008e-06 4.167008e-06 +45: testing matrix_inner< double , double > sym = false +45: timer: project 0.17s 0.17s +45: timer: compress 0.10s 0.10s +45: timer: new 0.06s 0.06s +45: timer: old 5.01s 5.01s +45: error norm 2.528753e-15 45: -45: MadnessException : +45: testing matrix_inner< double , double > sym = true +45: timer: project 0.10s 0.10s +45: timer: compress 0.02s 0.02s +45: timer: new 0.07s 0.07s +45: timer: old 2.84s 2.84s +45: error norm 1.059654e-06 45: -45: msg=ð : -45: value=1 : line=1462 : function=await : filename='./src/madness/world/thread.h' +45: error in multi_to_multi 1.618096e-15 1.710986e+00 2.430324e+00 +45: error in multi_to_multi 1.925602e-15 1.559791e+00 2.247142e+00 +45: testing cross product< double , double > +45: timer: project 0.03s 0.03s +45: timer: compress 0.04s 0.04s +45: error norm1 0.000000e+00 45: -45: MADNESS: fatal error: caught a MADNESS exception -45: Abort(1) on node 0 (rank 0 in comm 0): application called MPI_Abort(MPI_COMM_WORLD, 1) - process 0 -45: [ionos11-amd64:2677905:0:2677971] Caught signal 11 (Segmentation fault: address not mapped to object at address 0x564d388f8f44) -45: ==== backtrace (tid:2677971) ==== -45: 0 /lib/x86_64-linux-gnu/libucs.so.0(ucs_handle_error+0x2bc) [0x7f550e3bc95c] -45: 1 /lib/x86_64-linux-gnu/libucs.so.0(+0x2eb3f) [0x7f550e3bcb3f] -45: 2 /lib/x86_64-linux-gnu/libucs.so.0(+0x2ed0a) [0x7f550e3bcd0a] -45: 3 /lib/x86_64-linux-gnu/libc.so.6(+0x3d580) [0x7f550d653580] -45: 4 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0xba5a0) [0x564859fce5a0] -45: 5 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0xba6e8) [0x564859fce6e8] -45: 6 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0x385a18) [0x56485a299a18] -45: 7 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0x4276ac) [0x56485a33b6ac] -45: 8 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0x7de3aa) [0x56485a6f23aa] -45: 9 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0x7de4ed) [0x56485a6f24ed] -45: 10 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0x7de52f) [0x56485a6f252f] -45: 11 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0xa5239) [0x564859fb9239] -45: 12 /lib/x86_64-linux-gnu/libc.so.6(+0x89dab) [0x7f550d69fdab] -45: 13 /lib/x86_64-linux-gnu/libc.so.6(+0x10b9f8) [0x7f550d7219f8] -45: ================================= -45/56 Test #45: mra-testvmra ............................***Exception: SegFault 3.73 sec -MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +45: error norm2 0.000000e+00 +45: +45: error norm3 0.000000e+00 +45: +45: error norm4 7.750007e-04 (should not be zero) +45: +45: testing cross product< std::complex , double > +45: timer: project 0.03s 0.03s +45: timer: compress 0.01s 0.01s +45: error norm1 0.000000e+00 +45: +45: error norm2 0.000000e+00 +45: +45: error norm3 0.000000e+00 +45: +45: error norm4 2.738394e-04 (should not be zero) +45: +45: testing cross product< std::complex , std::complex > +45: timer: project 0.03s 0.03s +45: timer: compress 0.02s 0.02s +45: error norm1 0.000000e+00 +45: +45: error norm2 0.000000e+00 +45: +45: error norm3 0.000000e+00 +45: +45: error norm4 1.169653e-03 (should not be zero) +45: +45: testing rot operator< double , double > +45: timer: project 0.14s 0.14s +45: timer: compress 0.04s 0.04s +45: error norm1 5.791588e-05 +45: +45: error norm2 3.808435e-05 +45: +45: testing rot operator< std::complex , std::complex > +45: timer: project 0.13s 0.13s +45: timer: compress 0.02s 0.02s +45: error norm1 2.874658e-16 +45: +45: error norm2 8.636784e-07 +45: +45: error in multi_to_multi 2.490368e-15 1.568688e+00 2.313399e+00 +45: testing matrix_inner< double , std::complex > sym = false +45: timer: project 0.23s 0.23s +45: timer: compress 0.04s 0.04s +45: timer: new 0.05s 0.05s +45: timer: old 5.97s 5.97s +45: error norm 3.060441e-15 +45: +45: testing matrix_inner< std::complex , double > sym = false +45: timer: project 0.22s 0.22s +45: timer: compress 0.09s 0.09s +45: timer: new 0.05s 0.05s +45: timer: old 5.47s 5.47s +45: error norm 3.855789e-15 +45: +45: testing matrix_inner< std::complex , std::complex > sym = false +45: timer: project 0.17s 0.17s +45: timer: compress 0.06s 0.06s +45: timer: new 0.05s 0.05s +45: timer: old 5.15s 5.15s +45: error norm 5.211235e-15 +45: +45: testing matrix_inner< std::complex , std::complex > sym = true +45: timer: project 0.09s 0.09s +45: timer: compress 0.03s 0.03s +45: timer: new 0.05s 0.05s +45: timer: old 2.99s 2.99s +45: error norm 5.158257e-15 +45: +45: MADNESS runtime finalized but 1 world still exists +45/56 Test #45: mra-testvmra ............................***Timeout 1500.18 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 small test : 0 -!!MADNESS: Hung queue? -!!MADNESS: Hung queue? -!!MADNESS: Hung queue? -!!MADNESS: Hung queue? -!!MADNESS: Hung queue? -!!MADNESS ERROR: Exception thrown in WorldTaskQueue::fence() with 8 pending task(s) - -MadnessException : - -msg=ð : - value=1 : line=1462 : function=await : filename='./src/madness/world/thread.h' - -MADNESS: fatal error: caught a MADNESS exception -Abort(1) on node 0 (rank 0 in comm 0): application called MPI_Abort(MPI_COMM_WORLD, 1) - process 0 -[ionos11-amd64:2677905:0:2677971] Caught signal 11 (Segmentation fault: address not mapped to object at address 0x564d388f8f44) -==== backtrace (tid:2677971) ==== - 0 /lib/x86_64-linux-gnu/libucs.so.0(ucs_handle_error+0x2bc) [0x7f550e3bc95c] - 1 /lib/x86_64-linux-gnu/libucs.so.0(+0x2eb3f) [0x7f550e3bcb3f] - 2 /lib/x86_64-linux-gnu/libucs.so.0(+0x2ed0a) [0x7f550e3bcd0a] - 3 /lib/x86_64-linux-gnu/libc.so.6(+0x3d580) [0x7f550d653580] - 4 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0xba5a0) [0x564859fce5a0] - 5 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0xba6e8) [0x564859fce6e8] - 6 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0x385a18) [0x56485a299a18] - 7 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0x4276ac) [0x56485a33b6ac] - 8 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0x7de3aa) [0x56485a6f23aa] - 9 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0x7de4ed) [0x56485a6f24ed] -10 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0x7de52f) [0x56485a6f252f] -11 /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testvmra(+0xa5239) [0x564859fb9239] -12 /lib/x86_64-linux-gnu/libc.so.6(+0x89dab) [0x7f550d69fdab] -13 /lib/x86_64-linux-gnu/libc.so.6(+0x10b9f8) [0x7f550d7219f8] -================================= +errors in add 3.704781e-06 3.704781e-06 3.704781e-06 4.167008e-06 4.167008e-06 4.167008e-06 +errors in add 3.704781e-06 3.704781e-06 3.704781e-06 4.167008e-06 4.167008e-06 4.167008e-06 +testing matrix_inner< double , double > sym = false +timer: project 0.17s 0.17s +timer: compress 0.10s 0.10s +timer: new 0.06s 0.06s +timer: old 5.01s 5.01s +error norm 2.528753e-15 + +testing matrix_inner< double , double > sym = true +timer: project 0.10s 0.10s +timer: compress 0.02s 0.02s +timer: new 0.07s 0.07s +timer: old 2.84s 2.84s +error norm 1.059654e-06 + +error in multi_to_multi 1.618096e-15 1.710986e+00 2.430324e+00 +error in multi_to_multi 1.925602e-15 1.559791e+00 2.247142e+00 +testing cross product< double , double > +timer: project 0.03s 0.03s +timer: compress 0.04s 0.04s +error norm1 0.000000e+00 + +error norm2 0.000000e+00 + +error norm3 0.000000e+00 + +error norm4 7.750007e-04 (should not be zero) + +testing cross product< std::complex , double > +timer: project 0.03s 0.03s +timer: compress 0.01s 0.01s +error norm1 0.000000e+00 + +error norm2 0.000000e+00 + +error norm3 0.000000e+00 + +error norm4 2.738394e-04 (should not be zero) + +testing cross product< std::complex , std::complex > +timer: project 0.03s 0.03s +timer: compress 0.02s 0.02s +error norm1 0.000000e+00 + +error norm2 0.000000e+00 + +error norm3 0.000000e+00 + +error norm4 1.169653e-03 (should not be zero) + +testing rot operator< double , double > +timer: project 0.14s 0.14s +timer: compress 0.04s 0.04s +error norm1 5.791588e-05 + +error norm2 3.808435e-05 + +testing rot operator< std::complex , std::complex > +timer: project 0.13s 0.13s +timer: compress 0.02s 0.02s +error norm1 2.874658e-16 + +error norm2 8.636784e-07 + +error in multi_to_multi 2.490368e-15 1.568688e+00 2.313399e+00 +testing matrix_inner< double , std::complex > sym = false +timer: project 0.23s 0.23s +timer: compress 0.04s 0.04s +timer: new 0.05s 0.05s +timer: old 5.97s 5.97s +error norm 3.060441e-15 + +testing matrix_inner< std::complex , double > sym = false +timer: project 0.22s 0.22s +timer: compress 0.09s 0.09s +timer: new 0.05s 0.05s +timer: old 5.47s 5.47s +error norm 3.855789e-15 + +testing matrix_inner< std::complex , std::complex > sym = false +timer: project 0.17s 0.17s +timer: compress 0.06s 0.06s +timer: new 0.05s 0.05s +timer: old 5.15s 5.15s +error norm 5.211235e-15 + +testing matrix_inner< std::complex , std::complex > sym = true +timer: project 0.09s 0.09s +timer: compress 0.03s 0.03s +timer: new 0.05s 0.05s +timer: old 2.99s 2.99s +error norm 5.158257e-15 + +MADNESS runtime finalized but 1 world still exists test 46 Start 46: build_mra_sepop_unittests @@ -5144,25 +6046,25 @@ 46: gmake[4]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 46: gmake[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 46: -46/56 Test #46: build_mra_sepop_unittests ............... Passed 176.30 sec +46/56 Test #46: build_mra_sepop_unittests ............... Passed 655.61 sec test 47 Start 47: mra_sepop-testsuite 47: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testsuite 47: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra 47: Test timeout computed to be: 1500 -47: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +47: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 47: 47: -------------------------------------------- 47: MADNESS 0.10.1 multiresolution testsuite 47: -------------------------------------------- 47: 47: number of processors ... 1 -47: processor frequency ... 2.80875e+09 +47: processor frequency ... 2.39435e+09 47: host system ... Linux -47: configured by ... pbuilder1 -47: configured on ... ionos11-amd64 -47: configured at ... 2022-01-02T04:20:22 +47: configured by ... pbuilder2 +47: configured on ... i-capture-the-hostname +47: configured at ... 2022-01-03T06:20:22 47: CXX ... /usr/bin/c++ 47: CXXFLAGS ... -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 47: tuning for ... default @@ -5502,8 +6404,8 @@ 47: timer: truncate 0.00s 0.00s 47: timer: reconstruct 0.00s 0.00s 47: doing axis 0 -47: timer: diff 0.00s 0.00s -47: timer: err 0.01s 0.01s +47: timer: diff 0.02s 0.02s +47: timer: err 0.00s 0.00s 47: test_diff : 660 : err in test_diff : 1.93e-09 < 1.10e-08 : OK 47: error 1.93270596e-09 47: @@ -5513,7 +6415,7 @@ 47: timer: project 0.00s 0.00s 47: f norm is 1.00000000e+00 47: f total error 5.36725532e-11 -47: timer: apply 0.03s 0.03s +47: timer: apply 0.02s 0.02s 47: numeric at origin 8.51674586e-01 47: analytic at origin 8.51674586e-01 47: op*f norm is 5.49100487e-01 @@ -6082,7 +6984,7 @@ 47: timer: project 0.00s 0.00s 47: f norm is 1.00000000e+00 47: f total error 5.36725531e-11 -47: timer: apply 0.15s 0.16s +47: timer: apply 0.04s 0.04s 47: numeric at origin 4.25837293e-01+-7.37571827e-01j 47: analytic at origin 4.25837293e-01+-7.37571827e-01j 47: op*f norm is 5.49100487e-01 @@ -6305,10 +7207,10 @@ 47: test_basic : 222 : err : 8.09e-06 < 3.00e-05 : OK 47: test_basic : 223 : error at a point : 5.07e-08 < 1.00e-05 : OK 47: test_basic : 227 : new_norm : 1.11e-16 < 1.00e-14 : OK -47: test_basic : 232 : new_norm : 6.66e-16 < 1.00e-14 : OK +47: test_basic : 232 : new_norm : 5.55e-16 < 1.00e-14 : OK 47: test_basic : 233 : new_err : 1.19e-20 < 1.00e-14 : OK -47: test_basic : 237 : new_norm : 1.11e-15 < 1.00e-14 : OK -47: test_basic : 242 : new_norm : 1.11e-15 < 1.00e-09 : OK +47: test_basic : 237 : new_norm : 9.99e-16 < 1.00e-14 : OK +47: test_basic : 242 : new_norm : 9.99e-16 < 1.00e-09 : OK 47: test_basic : 243 : new_err : 8.09e-06 < 3.00e-05 : OK 47: projection, compression, reconstruction, truncation OK true 47: @@ -6422,7 +7324,7 @@ 47: n=1 err=4.75e-04 #coeff=1.44e+03 log(err)/(n*k)=4.03e-01 47: n=2 err=1.54e-06 #coeff=5.78e+03 log(err)/(n*k)=3.52e-01 47: n=3 err=9.20e-11 #coeff=2.31e+04 log(err)/(n*k)=4.05e-01 -47: n=4 err=2.58e-15 #coeff=9.24e+04 log(err)/(n*k)=4.42e-01 +47: n=4 err=2.59e-15 #coeff=9.24e+04 log(err)/(n*k)=4.42e-01 47: n=5 err=2.93e-15 #coeff=3.70e+05 log(err)/(n*k)=3.52e-01 47: k=20 47: n=1 err=2.13e-04 #coeff=1.60e+03 log(err)/(n*k)=4.23e-01 @@ -6488,7 +7390,7 @@ 47: n=1 err=7.20e-07 #coeff=3.60e+03 log(err)/(n*k)=4.71e-01 47: n=2 err=5.22e-12 #coeff=1.44e+04 log(err)/(n*k)=4.33e-01 47: n=3 err=6.99e-15 #coeff=5.76e+04 log(err)/(n*k)=3.62e-01 -47: n=4 err=5.15e-15 #coeff=2.30e+05 log(err)/(n*k)=2.74e-01 +47: n=4 err=5.14e-15 #coeff=2.30e+05 log(err)/(n*k)=2.74e-01 47: n=5 err=5.42e-15 #coeff=9.22e+05 log(err)/(n*k)=2.19e-01 47: test conv OK 47: @@ -6501,14 +7403,14 @@ 47: test_math : 377 : err in unaryp_op negate : 5.57e-16 < 1.00e-10 : OK 47: test_math : 384 : err in unaryp_op square : 0.00e+00 < 1.00e-10 : OK 47: test_math : 427 :add scalar in place compressed : 1.42e-14 < 1.00e-12 : OK -47: test_math : 433 :in-place scaling reconstructed : 1.42e-14 < 1.00e-12 : OK -47: test_math : 439 : in-place scaling compressed : 2.70e-13 < 1.00e-12 : OK -47: test_math : 445 : in-place scaling (op) recon : 2.61e-12 < 1.00e-11 : OK -47: test_math : 451 : in-place scaling (op) comp : 2.18e-11 < 1.00e-10 : OK +47: test_math : 433 :in-place scaling reconstructed : 2.13e-14 < 1.00e-12 : OK +47: test_math : 439 : in-place scaling compressed : 2.84e-13 < 1.00e-12 : OK +47: test_math : 445 : in-place scaling (op) recon : 3.18e-12 < 1.00e-11 : OK +47: test_math : 451 : in-place scaling (op) comp : 2.91e-11 < 1.00e-10 : OK 47: test_math : 457 : err in fsq by multiplication : 9.15e-09 < 3.00e-08 : OK 47: nnn 1.00000000e+00 -47: test_math : 471 : general op unchanged input : 1.91e-21 < 1.00e-14 : OK -47: test_math : 473 : general op output : 8.31e-15 < 1.00e-13 : OK +47: test_math : 471 : general op unchanged input : 3.10e-22 < 1.00e-14 : OK +47: test_math : 473 : general op output : 7.63e-15 < 1.00e-13 : OK 47: 47: Test multiplying random functions 47: test 0 @@ -6562,33 +7464,949 @@ 47: Test refining down to a common level 47: 47: Test multioperation -47: !!MADNESS: Hung queue? -47: !!MADNESS: Hung queue? -47: !!MADNESS: Hung queue? -47: !!MADNESS: Hung queue? -47: !!MADNESS: Hung queue? -47: !!MADNESS ERROR: Exception thrown in WorldTaskQueue::fence() with 32 pending task(s) -47: -47: MadnessException : -47: -47: msg= : -47: value=1 : line=1462 : function=await : filename='./src/madness/world/thread.h' -47: -47: MADNESS: fatal error: caught a MADNESS exception -47: Abort(1) on node 0 (rank 0 in comm 0): application called MPI_Abort(MPI_COMM_WORLD, 1) - process 0 -47/56 Test #47: mra_sepop-testsuite .....................***Failed 15.43 sec -MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +47: +47: Test DONE multi 3.16090643e-14 +47: +47: Test adding random functions out of place +47: test 0 +47: test_math : 562 : err1 : 2.01e-09 < 1.00e-08 : OK +47: test_math : 563 : err2 : 1.54e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 2.53e-09 < 1.00e-08 : OK +47: test 1 +47: test_math : 562 : err1 : 2.15e-09 < 1.00e-08 : OK +47: test_math : 563 : err2 : 2.28e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 3.14e-09 < 1.00e-08 : OK +47: test 2 +47: test_math : 562 : err1 : 5.08e-10 < 1.00e-08 : OK +47: test_math : 563 : err2 : 4.04e-10 < 1.00e-08 : OK +47: test_math : 564 : err3 : 6.48e-10 < 1.00e-08 : OK +47: test 3 +47: test_math : 562 : err1 : 1.67e-09 < 1.00e-08 : OK +47: test_math : 563 : err2 : 1.76e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 2.51e-09 < 1.00e-08 : OK +47: test 4 +47: test_math : 562 : err1 : 4.19e-10 < 1.00e-08 : OK +47: test_math : 563 : err2 : 1.89e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 1.94e-09 < 1.00e-08 : OK +47: test 5 +47: test_math : 562 : err1 : 9.55e-10 < 1.00e-08 : OK +47: test_math : 563 : err2 : 1.65e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 1.91e-09 < 1.00e-08 : OK +47: test 6 +47: test_math : 562 : err1 : 8.05e-10 < 1.00e-08 : OK +47: test_math : 563 : err2 : 7.19e-10 < 1.00e-08 : OK +47: test_math : 564 : err3 : 1.08e-09 < 1.00e-08 : OK +47: test 7 +47: test_math : 562 : err1 : 1.11e-09 < 1.00e-08 : OK +47: test_math : 563 : err2 : 4.14e-10 < 1.00e-08 : OK +47: test_math : 564 : err3 : 1.19e-09 < 1.00e-08 : OK +47: test 8 +47: test_math : 562 : err1 : 1.10e-09 < 1.00e-08 : OK +47: test_math : 563 : err2 : 1.95e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 2.24e-09 < 1.00e-08 : OK +47: test 9 +47: test_math : 562 : err1 : 3.10e-10 < 1.00e-08 : OK +47: test_math : 563 : err2 : 1.88e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 1.91e-09 < 1.00e-08 : OK +47: +47: Test adding random functions in place +47: test 0 +47: test_math : 581 : err1 : 2.19e-09 < 1.00e-08 : OK +47: test_math : 582 : err2 : 2.17e-09 < 1.00e-08 : OK +47: test 1 +47: test_math : 581 : err1 : 5.96e-10 < 1.00e-08 : OK +47: test_math : 582 : err2 : 3.42e-10 < 1.00e-08 : OK +47: test 2 +47: test_math : 581 : err1 : 1.61e-09 < 1.00e-08 : OK +47: test_math : 582 : err2 : 9.14e-10 < 1.00e-08 : OK +47: test 3 +47: test_math : 581 : err1 : 1.22e-09 < 1.00e-08 : OK +47: test_math : 582 : err2 : 1.06e-09 < 1.00e-08 : OK +47: test 4 +47: test_math : 581 : err1 : 2.73e-09 < 1.00e-08 : OK +47: test_math : 582 : err2 : 2.18e-09 < 1.00e-08 : OK +47: true +47: +47: Test differentiation - type = double , ndim = 2 +47: note that differentiation does not preserve the accuracy +47: in this particular case the threshold in loosened by a factor of 40 +47: +47: timer: project 0.00s 0.00s +47: timer: compress 0.00s 0.00s +47: timer: truncate 0.00s 0.00s +47: timer: reconstruct 0.00s 0.00s +47: doing axis 0 +47: timer: diff 0.02s 0.02s +47: timer: err 0.01s 0.01s +47: test_diff : 660 : err in test_diff : 6.65e-09 < 1.10e-08 : OK +47: error 6.64550318e-09 +47: doing axis 1 +47: timer: diff 0.02s 0.02s +47: timer: err 0.02s 0.02s +47: test_diff : 660 : err in test_diff : 6.65e-09 < 1.10e-08 : OK +47: error 6.64550289e-09 +47: +47: Test separated operators - type = double , ndim = 2 +47: +47: test_rnlp OK +47: timer: project 0.00s 0.00s +47: f norm is 1.00000000e+00 +47: f total error 2.30397738e-10 +47: timer: apply 0.03s 0.03s +47: numeric at origin 7.25349601e-01 +47: analytic at origin 7.25349601e-01 +47: op*f norm is 3.01511345e-01 +47: op*f total error 2.25726160e-08 +47: test_op : 767 : err in test_op : 2.26e-08 < 3.00e-08 : OK +47: +47: Test plot cube - type = double , ndim = 2 +47: +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.40e-22 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.46e-23 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.36e-24 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 5.35e-24 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 5.11e-24 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.57e-24 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.15e-24 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.62e-24 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 6.66e-25 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 7.18e-25 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 6.61e-25 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 9.79e-25 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 9.69e-26 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 8.43e-25 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 7.40e-24 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.58e-23 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.54e-23 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.37e-22 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.50e-22 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.45e-21 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.62e-21 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.40e-20 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.99e-20 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.07e-19 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.68e-19 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 8.04e-09 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.69e-18 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.89e-18 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 8.88e-18 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.96e-17 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.19e-17 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 8.72e-17 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.76e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.44e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 6.55e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.21e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.17e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.78e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 6.39e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.05e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.67e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.59e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.89e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 5.65e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 7.98e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.09e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.45e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.85e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.29e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.74e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.15e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.48e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.67e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.68e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.47e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.01e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.32e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.42e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.75e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 7.52e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.88e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.89e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.74e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.37e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.75e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.86e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.74e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.44e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.98e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.44e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.88e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.33e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.83e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.39e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.02e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 7.30e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 5.06e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.41e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.23e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.42e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 8.81e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 5.30e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.10e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.77e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 9.80e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 5.28e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.76e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.42e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 7.03e-17 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.40e-17 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.60e-17 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 7.35e-18 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.28e-18 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.43e-18 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 6.05e-19 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.49e-19 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.00e-19 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.89e-20 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.50e-20 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 5.71e-21 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.67e-21 < 2.00e-07 : OK +47: evaluation of cube/slice for plotting OK true +47: +47: Test IO - type = double , ndim = 2 +47: +47: err = 0.00000000e+00 +47: test_io : 1223 : test_io : 0.00e+00 < 1.00e-12 : OK +47: test_io OK +47: Test compression of a normalized gaussian at origin, type = double , ndim = 3 +47: test_basic : 221 : norm : 2.11e-10 < 3.00e-10 : OK +47: test_basic : 222 : err : 2.05e-05 < 3.00e-05 : OK +47: test_basic : 223 : error at a point : 9.95e-07 < 1.00e-05 : OK +47: test_basic : 227 : new_norm : 4.44e-16 < 1.00e-14 : OK +47: test_basic : 232 : new_norm : 1.67e-15 < 1.00e-14 : OK +47: test_basic : 233 : new_err : 6.78e-21 < 1.00e-14 : OK +47: test_basic : 237 : new_norm : 1.89e-15 < 1.00e-14 : OK +47: test_basic : 242 : new_norm : 1.89e-15 < 1.00e-09 : OK +47: test_basic : 243 : new_err : 2.05e-05 < 3.00e-05 : OK +47: projection, compression, reconstruction, truncation OK true +47: +47: +47: Test convergence - log(err)/(n*k) should be roughly const, a least for each value of k +47: - type = double , ndim = 3 +47: +47: k=2 +47: n=1 err=2.07e-01 #coeff=6.40e+01 log(err)/(n*k)=7.89e-01 +47: n=2 err=1.11e+00 #coeff=5.12e+02 log(err)/(n*k)=2.51e-02 +47: n=3 err=5.20e-01 #coeff=4.10e+03 log(err)/(n*k)=1.09e-01 +47: n=4 err=9.46e-02 #coeff=3.28e+04 log(err)/(n*k)=2.95e-01 +47: n=5 err=4.29e-02 #coeff=2.62e+05 log(err)/(n*k)=3.15e-01 +47: k=3 +47: n=1 err=9.31e-01 #coeff=2.16e+02 log(err)/(n*k)=2.37e-02 +47: n=2 err=6.05e-01 #coeff=1.73e+03 log(err)/(n*k)=8.37e-02 +47: n=3 err=1.39e-01 #coeff=1.38e+04 log(err)/(n*k)=2.20e-01 +47: n=4 err=5.19e-02 #coeff=1.11e+05 log(err)/(n*k)=2.46e-01 +47: n=5 err=5.05e-03 #coeff=8.85e+05 log(err)/(n*k)=3.53e-01 +47: k=4 +47: n=1 err=6.54e-01 #coeff=5.12e+02 log(err)/(n*k)=1.06e-01 +47: n=2 err=2.41e-01 #coeff=4.10e+03 log(err)/(n*k)=1.78e-01 +47: n=3 err=1.06e-01 #coeff=3.28e+04 log(err)/(n*k)=1.87e-01 +47: n=4 err=3.26e-03 #coeff=2.62e+05 log(err)/(n*k)=3.58e-01 +47: n=5 err=5.18e-04 #coeff=2.10e+06 log(err)/(n*k)=3.78e-01 +47: k=5 +47: n=1 err=4.31e-01 #coeff=1.00e+03 log(err)/(n*k)=1.69e-01 +47: n=2 err=1.58e-01 #coeff=8.00e+03 log(err)/(n*k)=1.84e-01 +47: n=3 err=2.13e-02 #coeff=6.40e+04 log(err)/(n*k)=2.57e-01 +47: n=4 err=1.78e-03 #coeff=5.12e+05 log(err)/(n*k)=3.17e-01 +47: n=5 err=5.04e-05 #coeff=4.10e+06 log(err)/(n*k)=3.96e-01 +47: k=6 +47: n=1 err=2.21e-01 #coeff=1.73e+03 log(err)/(n*k)=2.51e-01 +47: n=2 err=1.18e-01 #coeff=1.38e+04 log(err)/(n*k)=1.78e-01 +47: n=3 err=8.37e-03 #coeff=1.11e+05 log(err)/(n*k)=2.66e-01 +47: n=4 err=2.15e-04 #coeff=8.85e+05 log(err)/(n*k)=3.52e-01 +47: k=7 +47: n=1 err=1.38e-01 #coeff=2.74e+03 log(err)/(n*k)=2.83e-01 +47: n=2 err=4.41e-02 #coeff=2.20e+04 log(err)/(n*k)=2.23e-01 +47: n=3 err=3.72e-03 #coeff=1.76e+05 log(err)/(n*k)=2.66e-01 +47: n=4 err=3.88e-05 #coeff=1.40e+06 log(err)/(n*k)=3.63e-01 +47: k=8 +47: n=1 err=1.34e-01 #coeff=4.10e+03 log(err)/(n*k)=2.51e-01 +47: n=2 err=1.53e-02 #coeff=3.28e+04 log(err)/(n*k)=2.61e-01 +47: n=3 err=3.09e-04 #coeff=2.62e+05 log(err)/(n*k)=3.37e-01 +47: n=4 err=6.69e-06 #coeff=2.10e+06 log(err)/(n*k)=3.72e-01 +47: k=9 +47: n=1 err=1.00e-01 #coeff=5.83e+03 log(err)/(n*k)=2.55e-01 +47: n=2 err=1.46e-02 #coeff=4.67e+04 log(err)/(n*k)=2.35e-01 +47: n=3 err=3.08e-04 #coeff=3.73e+05 log(err)/(n*k)=2.99e-01 +47: n=4 err=6.06e-07 #coeff=2.99e+06 log(err)/(n*k)=3.98e-01 +47: k=10 +47: n=1 err=5.43e-02 #coeff=8.00e+03 log(err)/(n*k)=2.91e-01 +47: n=2 err=6.18e-03 #coeff=6.40e+04 log(err)/(n*k)=2.54e-01 +47: n=3 err=5.19e-05 #coeff=5.12e+05 log(err)/(n*k)=3.29e-01 +47: n=4 err=1.50e-07 #coeff=4.10e+06 log(err)/(n*k)=3.93e-01 +47: k=11 +47: n=1 err=2.31e-02 #coeff=1.06e+04 log(err)/(n*k)=3.43e-01 +47: n=2 err=1.36e-03 #coeff=8.52e+04 log(err)/(n*k)=3.00e-01 +47: n=3 err=1.46e-05 #coeff=6.81e+05 log(err)/(n*k)=3.37e-01 +47: n=4 err=5.75e-09 #coeff=5.45e+06 log(err)/(n*k)=4.31e-01 +47: k=12 +47: n=1 err=1.82e-02 #coeff=1.38e+04 log(err)/(n*k)=3.34e-01 +47: n=2 err=1.36e-03 #coeff=1.11e+05 log(err)/(n*k)=2.75e-01 +47: n=3 err=4.99e-06 #coeff=8.85e+05 log(err)/(n*k)=3.39e-01 +47: n=4 err=2.60e-09 #coeff=7.08e+06 log(err)/(n*k)=4.12e-01 +47: k=13 +47: n=1 err=1.67e-02 #coeff=1.76e+04 log(err)/(n*k)=3.15e-01 +47: n=2 err=5.73e-04 #coeff=1.41e+05 log(err)/(n*k)=2.87e-01 +47: n=3 err=3.57e-07 #coeff=1.12e+06 log(err)/(n*k)=3.81e-01 +47: n=4 err=4.02e-11 #coeff=9.00e+06 log(err)/(n*k)=4.60e-01 +47: k=14 +47: n=1 err=1.04e-02 #coeff=2.20e+04 log(err)/(n*k)=3.26e-01 +47: n=2 err=1.06e-04 #coeff=1.76e+05 log(err)/(n*k)=3.27e-01 +47: n=3 err=2.96e-07 #coeff=1.40e+06 log(err)/(n*k)=3.58e-01 +47: n=4 err=3.58e-11 #coeff=1.12e+07 log(err)/(n*k)=4.30e-01 +47: k=15 +47: n=1 err=4.32e-03 #coeff=2.70e+04 log(err)/(n*k)=3.63e-01 +47: n=2 err=1.05e-04 #coeff=2.16e+05 log(err)/(n*k)=3.05e-01 +47: n=3 err=2.44e-08 #coeff=1.73e+06 log(err)/(n*k)=3.90e-01 +47: n=4 err=1.35e-12 #coeff=1.38e+07 log(err)/(n*k)=4.56e-01 +47: k=16 +47: n=1 err=2.21e-03 #coeff=3.28e+04 log(err)/(n*k)=3.82e-01 +47: n=2 err=3.85e-05 #coeff=2.62e+05 log(err)/(n*k)=3.18e-01 +47: n=3 err=1.22e-08 #coeff=2.10e+06 log(err)/(n*k)=3.80e-01 +47: n=4 err=4.00e-13 #coeff=1.68e+07 log(err)/(n*k)=4.46e-01 +47: k=17 +47: n=1 err=2.19e-03 #coeff=3.93e+04 log(err)/(n*k)=3.60e-01 +47: n=2 err=7.26e-06 #coeff=3.14e+05 log(err)/(n*k)=3.48e-01 +47: n=3 err=2.11e-09 #coeff=2.52e+06 log(err)/(n*k)=3.92e-01 +47: n=4 err=2.50e-14 #coeff=2.01e+07 log(err)/(n*k)=4.61e-01 +47: k=18 +47: n=1 err=1.44e-03 #coeff=4.67e+04 log(err)/(n*k)=3.63e-01 +47: n=2 err=6.88e-06 #coeff=3.73e+05 log(err)/(n*k)=3.30e-01 +47: n=3 err=3.51e-10 #coeff=2.99e+06 log(err)/(n*k)=4.03e-01 +47: n=4 err=4.48e-15 #coeff=2.39e+07 log(err)/(n*k)=4.59e-01 +47: k=19 +47: n=1 err=5.82e-04 #coeff=5.49e+04 log(err)/(n*k)=3.92e-01 +47: n=2 err=1.88e-06 #coeff=4.39e+05 log(err)/(n*k)=3.47e-01 +47: n=3 err=1.13e-10 #coeff=3.51e+06 log(err)/(n*k)=4.02e-01 +47: n=4 err=3.16e-15 #coeff=2.81e+07 log(err)/(n*k)=4.39e-01 +47: k=20 +47: n=1 err=2.60e-04 #coeff=6.40e+04 log(err)/(n*k)=4.13e-01 +47: n=2 err=5.18e-07 #coeff=5.12e+05 log(err)/(n*k)=3.62e-01 +47: n=3 err=5.90e-12 #coeff=4.10e+06 log(err)/(n*k)=4.31e-01 +47: n=4 err=4.30e-15 #coeff=3.28e+07 log(err)/(n*k)=4.14e-01 +47: k=21 +47: n=1 err=2.58e-04 #coeff=7.41e+04 log(err)/(n*k)=3.93e-01 +47: n=2 err=3.61e-07 #coeff=5.93e+05 log(err)/(n*k)=3.53e-01 +47: n=3 err=4.45e-12 #coeff=4.74e+06 log(err)/(n*k)=4.15e-01 +47: n=4 err=4.48e-15 #coeff=3.79e+07 log(err)/(n*k)=3.93e-01 +47: k=22 +47: n=1 err=1.59e-04 #coeff=8.52e+04 log(err)/(n*k)=3.98e-01 +47: n=2 err=6.25e-08 #coeff=6.81e+05 log(err)/(n*k)=3.77e-01 +47: n=3 err=2.30e-13 #coeff=5.45e+06 log(err)/(n*k)=4.41e-01 +47: n=4 err=4.56e-15 #coeff=4.36e+07 log(err)/(n*k)=3.75e-01 +47: k=23 +47: n=1 err=5.62e-05 #coeff=9.73e+04 log(err)/(n*k)=4.25e-01 +47: n=2 err=3.33e-08 #coeff=7.79e+05 log(err)/(n*k)=3.74e-01 +47: n=3 err=1.39e-13 #coeff=6.23e+06 log(err)/(n*k)=4.29e-01 +47: n=4 err=4.18e-15 #coeff=4.98e+07 log(err)/(n*k)=3.60e-01 +47: k=24 +47: n=1 err=2.96e-05 #coeff=1.11e+05 log(err)/(n*k)=4.35e-01 +47: n=2 err=1.44e-08 #coeff=8.85e+05 log(err)/(n*k)=3.76e-01 +47: n=3 err=1.59e-14 #coeff=7.08e+06 log(err)/(n*k)=4.41e-01 +47: n=4 err=3.23e-15 #coeff=5.66e+07 log(err)/(n*k)=3.48e-01 +47: k=25 +47: n=1 err=2.72e-05 #coeff=1.25e+05 log(err)/(n*k)=4.20e-01 +47: n=2 err=1.63e-09 #coeff=1.00e+06 log(err)/(n*k)=4.05e-01 +47: n=3 err=9.46e-15 #coeff=8.00e+06 log(err)/(n*k)=4.31e-01 +47: n=4 err=6.01e-15 #coeff=6.40e+07 log(err)/(n*k)=3.27e-01 +47: k=26 +47: n=1 err=1.39e-05 #coeff=1.41e+05 log(err)/(n*k)=4.30e-01 +47: n=2 err=1.63e-09 #coeff=1.12e+06 log(err)/(n*k)=3.89e-01 +47: n=3 err=9.07e-15 #coeff=9.00e+06 log(err)/(n*k)=4.15e-01 +47: n=4 err=6.68e-15 #coeff=7.20e+07 log(err)/(n*k)=3.14e-01 +47: k=27 +47: n=1 err=4.05e-06 #coeff=1.57e+05 log(err)/(n*k)=4.60e-01 +47: n=2 err=3.97e-10 #coeff=1.26e+06 log(err)/(n*k)=4.01e-01 +47: n=3 err=8.52e-15 #coeff=1.01e+07 log(err)/(n*k)=4.00e-01 +47: n=4 err=6.45e-15 #coeff=8.06e+07 log(err)/(n*k)=3.03e-01 +47: k=28 +47: n=1 err=3.31e-06 #coeff=1.76e+05 log(err)/(n*k)=4.51e-01 +47: n=2 err=9.69e-11 #coeff=1.40e+06 log(err)/(n*k)=4.12e-01 +47: n=3 err=9.23e-15 #coeff=1.12e+07 log(err)/(n*k)=3.85e-01 +47: n=4 err=7.04e-15 #coeff=8.99e+07 log(err)/(n*k)=2.91e-01 +47: k=29 +47: n=1 err=2.39e-06 #coeff=1.95e+05 log(err)/(n*k)=4.46e-01 +47: n=2 err=5.69e-11 #coeff=1.56e+06 log(err)/(n*k)=4.07e-01 +47: n=3 err=6.53e-15 #coeff=1.25e+07 log(err)/(n*k)=3.75e-01 +47: n=4 err=5.15e-15 #coeff=9.99e+07 log(err)/(n*k)=2.84e-01 +47: k=30 +47: n=1 err=8.82e-07 #coeff=2.16e+05 log(err)/(n*k)=4.65e-01 +47: n=2 err=6.39e-12 #coeff=1.73e+06 log(err)/(n*k)=4.30e-01 +47: n=3 err=8.58e-15 #coeff=1.38e+07 log(err)/(n*k)=3.60e-01 +47: n=4 err=6.29e-15 #coeff=1.11e+08 log(err)/(n*k)=2.72e-01 +47: test conv OK +47: +47: +47: Test basic math operations - type = double , ndim = 3 +47: +47: test_math : 367 : err in f before squaring : 2.88e-09 < 3.00e-09 : OK +47: test_math : 370 : err in f after squaring : 0.00e+00 < 2.88e-23 : OK +47: test_math : 372 : err in fsq : 2.14e-08 < 2.20e-08 : OK +47: test_math : 377 : err in unaryp_op negate : 7.13e-16 < 1.00e-10 : OK +47: test_math : 384 : err in unaryp_op square : 0.00e+00 < 1.00e-10 : OK +47: test_math : 427 :add scalar in place compressed : 5.51e-14 < 1.00e-12 : OK +47: test_math : 433 :in-place scaling reconstructed : 1.35e-13 < 1.00e-12 : OK +47: test_math : 439 : in-place scaling compressed : 8.10e-13 < 1.00e-12 : OK +47: test_math : 445 : in-place scaling (op) recon : 4.55e-12 < 1.00e-11 : OK +47: test_math : 451 : in-place scaling (op) comp : 4.27e-11 < 1.00e-10 : OK +47: test_math : 457 : err in fsq by multiplication : 2.14e-08 < 3.00e-08 : OK +47: nnn 1.00000000e+00 +47: test_math : 471 : general op unchanged input : 4.00e-22 < 1.00e-14 : OK +47: test_math : 473 : general op output : 1.25e-14 < 1.00e-13 : OK +47: +47: Test multiplying random functions +47: test 0 +47: test_math : 498 : err1 : 1.83e-09 < 1.00e-08 : OK +47: test_math : 499 : err2 : 3.87e-09 < 1.00e-08 : OK +47: test_math : 500 : err3 : 2.61e-14 < 1.00e-08 : OK +47: test 1 +47: test_math : 498 : err1 : 2.20e-09 < 1.00e-08 : OK +47: test_math : 499 : err2 : 1.36e-09 < 1.00e-08 : OK +47: test_math : 500 : err3 : 1.07e-100 < 1.00e-08 : OK +47: test 2 +47: test_math : 498 : err1 : 3.97e-09 < 1.00e-08 : OK +47: test_math : 499 : err2 : 1.04e-09 < 1.00e-08 : OK +47: test_math : 500 : err3 : 1.29e-12 < 1.00e-08 : OK +47: test 3 +47: test_math : 498 : err1 : 8.33e-10 < 1.00e-08 : OK +47: test_math : 499 : err2 : 4.36e-09 < 1.00e-08 : OK +47: test_math : 500 : err3 : 8.26e-17 < 1.00e-08 : OK +47: test 4 +47: test_math : 498 : err1 : 7.20e-10 < 1.00e-08 : OK +47: test_math : 499 : err2 : 1.02e-09 < 1.00e-08 : OK +47: test_math : 500 : err3 : 0.00e+00 < 1.00e-08 : OK +47: +47: Test multiplying a vector of random functions +47: test_math : 530 : err : 6.85e-15 < 1.00e-08 : OK +47: test_math : 530 : err : 6.35e-14 < 1.00e-08 : OK +47: test_math : 530 : err : 2.09e-20 < 1.00e-08 : OK +47: test_math : 530 : err : 1.52e-17 < 1.00e-08 : OK +47: test_math : 530 : err : 6.81e-17 < 1.00e-08 : OK +47: +47: Test refining down to a common level +47: +47: Test multioperation +47: +47: Test DONE multi 9.22710131e-14 +47: +47: Test adding random functions out of place +47: test 0 +47: test_math : 562 : err1 : 1.52e-09 < 1.00e-08 : OK +47: test_math : 563 : err2 : 8.05e-10 < 1.00e-08 : OK +47: test_math : 564 : err3 : 1.72e-09 < 1.00e-08 : OK +47: test 1 +47: test_math : 562 : err1 : 2.09e-09 < 1.00e-08 : OK +47: test_math : 563 : err2 : 2.69e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 3.42e-09 < 1.00e-08 : OK +47: test 2 +47: test_math : 562 : err1 : 3.85e-09 < 1.00e-08 : OK +47: test_math : 563 : err2 : 1.57e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 4.16e-09 < 1.00e-08 : OK +47: test 3 +47: test_math : 562 : err1 : 7.56e-10 < 1.00e-08 : OK +47: test_math : 563 : err2 : 8.78e-10 < 1.00e-08 : OK +47: test_math : 564 : err3 : 1.16e-09 < 1.00e-08 : OK +47: test 4 +47: test_math : 562 : err1 : 3.81e-09 < 1.00e-08 : OK +47: test_math : 563 : err2 : 4.32e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 5.78e-09 < 1.00e-08 : OK +47: test 5 +47: test_math : 562 : err1 : 4.06e-09 < 1.00e-08 : OK +47: test_math : 563 : err2 : 1.19e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 4.23e-09 < 1.00e-08 : OK +47: test 6 +47: test_math : 562 : err1 : 2.21e-09 < 1.00e-08 : OK +47: test_math : 563 : err2 : 1.34e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 2.59e-09 < 1.00e-08 : OK +47: test 7 +47: test_math : 562 : err1 : 8.46e-10 < 1.00e-08 : OK +47: test_math : 563 : err2 : 3.07e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 3.18e-09 < 1.00e-08 : OK +47: test 8 +47: test_math : 562 : err1 : 3.85e-09 < 1.00e-08 : OK +47: test_math : 563 : err2 : 2.36e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 4.52e-09 < 1.00e-08 : OK +47: test 9 +47: test_math : 562 : err1 : 9.23e-10 < 1.00e-08 : OK +47: test_math : 563 : err2 : 2.71e-09 < 1.00e-08 : OK +47: test_math : 564 : err3 : 2.87e-09 < 1.00e-08 : OK +47: +47: Test adding random functions in place +47: test 0 +47: test_math : 581 : err1 : 3.93e-09 < 1.00e-08 : OK +47: test_math : 582 : err2 : 2.17e-09 < 1.00e-08 : OK +47: test 1 +47: test_math : 581 : err1 : 5.56e-09 < 1.00e-08 : OK +47: test_math : 582 : err2 : 4.67e-09 < 1.00e-08 : OK +47: test 2 +47: test_math : 581 : err1 : 6.24e-09 < 1.00e-08 : OK +47: test_math : 582 : err2 : 4.21e-09 < 1.00e-08 : OK +47: test 3 +47: test_math : 581 : err1 : 4.66e-09 < 1.00e-08 : OK +47: test_math : 582 : err2 : 4.30e-09 < 1.00e-08 : OK +47: test 4 +47: test_math : 581 : err1 : 4.75e-09 < 1.00e-08 : OK +47: test_math : 582 : err2 : 3.79e-09 < 1.00e-08 : OK +47: true +47: +47: Test differentiation - type = double , ndim = 3 +47: note that differentiation does not preserve the accuracy +47: in this particular case the threshold in loosened by a factor of 40 +47: +47: timer: project 0.17s 0.17s +47: timer: compress 0.22s 0.22s +47: timer: truncate 0.03s 0.03s +47: timer: reconstruct 0.08s 0.08s +47: doing axis 0 +47: timer: diff 0.08s 0.08s +47: timer: err 0.06s 0.06s +47: test_diff : 660 : err in test_diff : 1.05e-08 < 1.10e-08 : OK +47: error 1.04688288e-08 +47: doing axis 1 +47: timer: diff 0.13s 0.13s +47: timer: err 0.06s 0.06s +47: test_diff : 660 : err in test_diff : 1.05e-08 < 1.10e-08 : OK +47: error 1.04688290e-08 +47: doing axis 2 +47: timer: diff 0.11s 0.11s +47: timer: err 0.08s 0.08s +47: test_diff : 660 : err in test_diff : 1.05e-08 < 1.10e-08 : OK +47: error 1.04688286e-08 +47: +47: Test separated operators - type = double , ndim = 3 +47: +47: test_rnlp OK +47: timer: project 0.24s 0.24s +47: f norm is 1.00000000e+00 +47: f total error 5.40466946e-10 +47: timer: apply 0.73s 0.73s +47: numeric at origin 6.17761821e-01 +47: analytic at origin 6.17761821e-01 +47: op*f norm is 1.65560026e-01 +47: op*f total error 9.87258981e-09 +47: test_op : 767 : err in test_op : 9.87e-09 < 3.00e-08 : OK +47: +47: Test Coulomb operator - type = double , ndim = 3 (only) +47: +47: timer: project 0.22s 0.22s +47: f norm is 7.96828940e+00 +47: f total error 3.50098300e-08 +47: test_coulomb : 845 : test_coulomb 1 : 3.50e-08 < 1.00e-07 : OK +47: timer: nonstandard 0.08s 0.08s +47: +47: before operator +47: +47: timer: apply 6.03s 6.03s +47: timer: reconstruct result 0.08s 0.08s +47: numeric at origin 1.12837917e+01 +47: analytic at origin 1.12837917e+01 +47: op*f norm is 1.23376952e+01 +47: op*f total error 1.21353196e-07 +47: test_coulomb : 901 : err in test_coulomb : 1.21e-07 < 1.00e-06 : OK +47: +47: Test plot cube - type = double , ndim = 3 +47: +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 6.88e-28 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.43e-27 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 7.80e-28 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.80e-28 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 8.49e-29 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.52e-28 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.13e-28 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.35e-28 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.03e-28 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.52e-28 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.64e-30 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 5.14e-29 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.88e-28 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.32e-28 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.91e-28 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.01e-28 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.32e-28 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.42e-27 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.81e-26 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 9.44e-26 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.95e-25 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.47e-24 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.15e-23 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.90e-23 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.90e-22 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 8.73e-12 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.69e-21 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 9.89e-21 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.25e-20 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.07e-19 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.31e-19 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 9.78e-19 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.79e-18 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 7.57e-18 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.99e-17 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.99e-17 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.19e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.75e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 6.08e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.28e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.61e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 5.07e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 9.44e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.68e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.87e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.69e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 7.33e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.09e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.55e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.10e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.70e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.30e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.80e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.10e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.13e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.76e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.00e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.89e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.95e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.01e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.47e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.70e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.61e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 5.10e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 5.17e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.90e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.36e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.67e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.93e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.23e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.62e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.12e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 7.41e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.69e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.84e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.65e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 9.20e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.91e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.52e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.24e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 5.85e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.65e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.15e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.82e-17 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.94e-17 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 7.45e-18 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.76e-18 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 9.28e-19 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.37e-19 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.11e-19 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.50e-20 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.07e-20 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.11e-21 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 8.74e-22 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.36e-22 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 6.12e-23 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.52e-23 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.73e-24 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.54e-25 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.26e-26 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.33e-24 < 2.00e-07 : OK +47: evaluation of cube/slice for plotting OK true +47: +47: Test IO - type = double , ndim = 3 +47: +47: err = 0.00000000e+00 +47: test_io : 1223 : test_io : 0.00e+00 < 1.00e-12 : OK +47: test_io OK +47: +47: Test plot cube - type = double , ndim = 4 +47: +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.66e-30 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.29e-32 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 8.66e-32 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.71e-32 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.75e-29 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 8.43e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.29e-21 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.81e-18 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.62e-16 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.79e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.06e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.17e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 2.89e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 4.39e-13 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 8.05e-14 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.33e-15 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 3.47e-17 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 9.21e-20 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 1.26e-22 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 6.13e-22 < 2.00e-07 : OK +47: test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK +47: test_plot : 1165 : plot-eval : 9.64e-21 < 2.00e-07 : OK +47: evaluation of cube/slice for plotting OK true +47: entering final fence +47: done with final fence +47: +47: Final tensor instance count 0 +47: +47: Parallel environment +47: -------------------- +47: #nodes 1 +47: #threads per node 127+main = 128 +47: #total threads 128 +47: +47: RMI message statistics (min / avg / max) +47: ---------------------- +47: #messages in server q 0.00e+00 / 0.00e+00 / 0.00e+00 +47: #messages sent per node 0.00e+00 / 0.00e+00 / 0.00e+00 +47: #bytes sent per node 0.00e+00 / 0.00e+00 / 0.00e+00 +47: #messages recv per node 0.00e+00 / 0.00e+00 / 0.00e+00 +47: #bytes recv per node 0.00e+00 / 0.00e+00 / 0.00e+00 +47: #msgs systemwide 0.00e+00 +47: #bytes systemwide 0.00e+00 +47: +47: Thread pool statistics (min / avg / max) +47: ---------------------- +47: #tasks per node 2.92e+06 / 2.92e+06 / 2.92e+06 +47: #max q len per node 1.42e+04 / 1.42e+04 / 1.42e+04 +47: #hi-pri tasks per node 3.28e+05 / 3.28e+05 / 3.28e+05 +47: +47: Total wall time 156.5s +47: Total cpu time 156.5s +47: +47: testsuite passed: true +47: +47/56 Test #47: mra_sepop-testsuite .....................***Timeout 1500.21 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 -------------------------------------------- MADNESS 0.10.1 multiresolution testsuite -------------------------------------------- number of processors ... 1 - processor frequency ... 2.80875e+09 + processor frequency ... 2.39435e+09 host system ... Linux - configured by ... pbuilder1 - configured on ... ionos11-amd64 - configured at ... 2022-01-02T04:20:22 + configured by ... pbuilder2 + configured on ... i-capture-the-hostname + configured at ... 2022-01-03T06:20:22 CXX ... /usr/bin/c++ CXXFLAGS ... -g -O2 -ffile-prefix-map=/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f=. -fstack-protector-strong -fstack-clash-protection -Wformat -Werror=format-security -fcf-protection -Wdate-time -D_FORTIFY_SOURCE=2 -std=c++17 tuning for ... default @@ -6928,8 +8746,8 @@ timer: truncate 0.00s 0.00s timer: reconstruct 0.00s 0.00s doing axis 0 -timer: diff 0.00s 0.00s -timer: err 0.01s 0.01s +timer: diff 0.02s 0.02s +timer: err 0.00s 0.00s test_diff : 660 : err in test_diff : 1.93e-09 < 1.10e-08 : OK error 1.93270596e-09 @@ -6939,7 +8757,7 @@ timer: project 0.00s 0.00s f norm is 1.00000000e+00 f total error 5.36725532e-11 -timer: apply 0.03s 0.03s +timer: apply 0.02s 0.02s numeric at origin 8.51674586e-01 analytic at origin 8.51674586e-01 op*f norm is 5.49100487e-01 @@ -7508,7 +9326,7 @@ timer: project 0.00s 0.00s f norm is 1.00000000e+00 f total error 5.36725531e-11 -timer: apply 0.15s 0.16s +timer: apply 0.04s 0.04s numeric at origin 4.25837293e-01+-7.37571827e-01j analytic at origin 4.25837293e-01+-7.37571827e-01j op*f norm is 5.49100487e-01 @@ -7731,10 +9549,10 @@ test_basic : 222 : err : 8.09e-06 < 3.00e-05 : OK test_basic : 223 : error at a point : 5.07e-08 < 1.00e-05 : OK test_basic : 227 : new_norm : 1.11e-16 < 1.00e-14 : OK - test_basic : 232 : new_norm : 6.66e-16 < 1.00e-14 : OK + test_basic : 232 : new_norm : 5.55e-16 < 1.00e-14 : OK test_basic : 233 : new_err : 1.19e-20 < 1.00e-14 : OK - test_basic : 237 : new_norm : 1.11e-15 < 1.00e-14 : OK - test_basic : 242 : new_norm : 1.11e-15 < 1.00e-09 : OK + test_basic : 237 : new_norm : 9.99e-16 < 1.00e-14 : OK + test_basic : 242 : new_norm : 9.99e-16 < 1.00e-09 : OK test_basic : 243 : new_err : 8.09e-06 < 3.00e-05 : OK projection, compression, reconstruction, truncation OK true @@ -7848,7 +9666,7 @@ n=1 err=4.75e-04 #coeff=1.44e+03 log(err)/(n*k)=4.03e-01 n=2 err=1.54e-06 #coeff=5.78e+03 log(err)/(n*k)=3.52e-01 n=3 err=9.20e-11 #coeff=2.31e+04 log(err)/(n*k)=4.05e-01 - n=4 err=2.58e-15 #coeff=9.24e+04 log(err)/(n*k)=4.42e-01 + n=4 err=2.59e-15 #coeff=9.24e+04 log(err)/(n*k)=4.42e-01 n=5 err=2.93e-15 #coeff=3.70e+05 log(err)/(n*k)=3.52e-01 k=20 n=1 err=2.13e-04 #coeff=1.60e+03 log(err)/(n*k)=4.23e-01 @@ -7914,7 +9732,7 @@ n=1 err=7.20e-07 #coeff=3.60e+03 log(err)/(n*k)=4.71e-01 n=2 err=5.22e-12 #coeff=1.44e+04 log(err)/(n*k)=4.33e-01 n=3 err=6.99e-15 #coeff=5.76e+04 log(err)/(n*k)=3.62e-01 - n=4 err=5.15e-15 #coeff=2.30e+05 log(err)/(n*k)=2.74e-01 + n=4 err=5.14e-15 #coeff=2.30e+05 log(err)/(n*k)=2.74e-01 n=5 err=5.42e-15 #coeff=9.22e+05 log(err)/(n*k)=2.19e-01 test conv OK @@ -7927,14 +9745,14 @@ test_math : 377 : err in unaryp_op negate : 5.57e-16 < 1.00e-10 : OK test_math : 384 : err in unaryp_op square : 0.00e+00 < 1.00e-10 : OK test_math : 427 :add scalar in place compressed : 1.42e-14 < 1.00e-12 : OK - test_math : 433 :in-place scaling reconstructed : 1.42e-14 < 1.00e-12 : OK - test_math : 439 : in-place scaling compressed : 2.70e-13 < 1.00e-12 : OK - test_math : 445 : in-place scaling (op) recon : 2.61e-12 < 1.00e-11 : OK - test_math : 451 : in-place scaling (op) comp : 2.18e-11 < 1.00e-10 : OK + test_math : 433 :in-place scaling reconstructed : 2.13e-14 < 1.00e-12 : OK + test_math : 439 : in-place scaling compressed : 2.84e-13 < 1.00e-12 : OK + test_math : 445 : in-place scaling (op) recon : 3.18e-12 < 1.00e-11 : OK + test_math : 451 : in-place scaling (op) comp : 2.91e-11 < 1.00e-10 : OK test_math : 457 : err in fsq by multiplication : 9.15e-09 < 3.00e-08 : OK nnn 1.00000000e+00 - test_math : 471 : general op unchanged input : 1.91e-21 < 1.00e-14 : OK - test_math : 473 : general op output : 8.31e-15 < 1.00e-13 : OK + test_math : 471 : general op unchanged input : 3.10e-22 < 1.00e-14 : OK + test_math : 473 : general op output : 7.63e-15 < 1.00e-13 : OK Test multiplying random functions test 0 @@ -7988,20 +9806,936 @@ Test refining down to a common level Test multioperation -!!MADNESS: Hung queue? -!!MADNESS: Hung queue? -!!MADNESS: Hung queue? -!!MADNESS: Hung queue? -!!MADNESS: Hung queue? -!!MADNESS ERROR: Exception thrown in WorldTaskQueue::fence() with 32 pending task(s) -MadnessException : +Test DONE multi 3.16090643e-14 + +Test adding random functions out of place + test 0 + test_math : 562 : err1 : 2.01e-09 < 1.00e-08 : OK + test_math : 563 : err2 : 1.54e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 2.53e-09 < 1.00e-08 : OK + test 1 + test_math : 562 : err1 : 2.15e-09 < 1.00e-08 : OK + test_math : 563 : err2 : 2.28e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 3.14e-09 < 1.00e-08 : OK + test 2 + test_math : 562 : err1 : 5.08e-10 < 1.00e-08 : OK + test_math : 563 : err2 : 4.04e-10 < 1.00e-08 : OK + test_math : 564 : err3 : 6.48e-10 < 1.00e-08 : OK + test 3 + test_math : 562 : err1 : 1.67e-09 < 1.00e-08 : OK + test_math : 563 : err2 : 1.76e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 2.51e-09 < 1.00e-08 : OK + test 4 + test_math : 562 : err1 : 4.19e-10 < 1.00e-08 : OK + test_math : 563 : err2 : 1.89e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 1.94e-09 < 1.00e-08 : OK + test 5 + test_math : 562 : err1 : 9.55e-10 < 1.00e-08 : OK + test_math : 563 : err2 : 1.65e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 1.91e-09 < 1.00e-08 : OK + test 6 + test_math : 562 : err1 : 8.05e-10 < 1.00e-08 : OK + test_math : 563 : err2 : 7.19e-10 < 1.00e-08 : OK + test_math : 564 : err3 : 1.08e-09 < 1.00e-08 : OK + test 7 + test_math : 562 : err1 : 1.11e-09 < 1.00e-08 : OK + test_math : 563 : err2 : 4.14e-10 < 1.00e-08 : OK + test_math : 564 : err3 : 1.19e-09 < 1.00e-08 : OK + test 8 + test_math : 562 : err1 : 1.10e-09 < 1.00e-08 : OK + test_math : 563 : err2 : 1.95e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 2.24e-09 < 1.00e-08 : OK + test 9 + test_math : 562 : err1 : 3.10e-10 < 1.00e-08 : OK + test_math : 563 : err2 : 1.88e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 1.91e-09 < 1.00e-08 : OK + +Test adding random functions in place + test 0 + test_math : 581 : err1 : 2.19e-09 < 1.00e-08 : OK + test_math : 582 : err2 : 2.17e-09 < 1.00e-08 : OK + test 1 + test_math : 581 : err1 : 5.96e-10 < 1.00e-08 : OK + test_math : 582 : err2 : 3.42e-10 < 1.00e-08 : OK + test 2 + test_math : 581 : err1 : 1.61e-09 < 1.00e-08 : OK + test_math : 582 : err2 : 9.14e-10 < 1.00e-08 : OK + test 3 + test_math : 581 : err1 : 1.22e-09 < 1.00e-08 : OK + test_math : 582 : err2 : 1.06e-09 < 1.00e-08 : OK + test 4 + test_math : 581 : err1 : 2.73e-09 < 1.00e-08 : OK + test_math : 582 : err2 : 2.18e-09 < 1.00e-08 : OK +true + +Test differentiation - type = double , ndim = 2 +note that differentiation does not preserve the accuracy +in this particular case the threshold in loosened by a factor of 40 + +timer: project 0.00s 0.00s +timer: compress 0.00s 0.00s +timer: truncate 0.00s 0.00s +timer: reconstruct 0.00s 0.00s +doing axis 0 +timer: diff 0.02s 0.02s +timer: err 0.01s 0.01s + test_diff : 660 : err in test_diff : 6.65e-09 < 1.10e-08 : OK + error 6.64550318e-09 +doing axis 1 +timer: diff 0.02s 0.02s +timer: err 0.02s 0.02s + test_diff : 660 : err in test_diff : 6.65e-09 < 1.10e-08 : OK + error 6.64550289e-09 + +Test separated operators - type = double , ndim = 2 + +test_rnlp OK +timer: project 0.00s 0.00s + f norm is 1.00000000e+00 + f total error 2.30397738e-10 +timer: apply 0.03s 0.03s + numeric at origin 7.25349601e-01 +analytic at origin 7.25349601e-01 + op*f norm is 3.01511345e-01 + op*f total error 2.25726160e-08 + test_op : 767 : err in test_op : 2.26e-08 < 3.00e-08 : OK + +Test plot cube - type = double , ndim = 2 + + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.40e-22 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.46e-23 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.36e-24 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 5.35e-24 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 5.11e-24 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.57e-24 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.15e-24 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.62e-24 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 6.66e-25 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 7.18e-25 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 6.61e-25 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 9.79e-25 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 9.69e-26 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 8.43e-25 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 7.40e-24 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.58e-23 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.54e-23 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.37e-22 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.50e-22 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.45e-21 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.62e-21 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.40e-20 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.99e-20 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.07e-19 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.68e-19 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 8.04e-09 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.69e-18 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.89e-18 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 8.88e-18 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.96e-17 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.19e-17 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 8.72e-17 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.76e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.44e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 6.55e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.21e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.17e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.78e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 6.39e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.05e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.67e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.59e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.89e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 5.65e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 7.98e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.09e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.45e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.85e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.29e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.74e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.15e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.48e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.67e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.68e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.47e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.01e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.32e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.42e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.75e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 7.52e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.88e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.89e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.74e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.37e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.75e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.86e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.74e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.44e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.98e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.44e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.88e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.33e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.83e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.39e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.02e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 7.30e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 5.06e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.41e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.23e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.42e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 8.81e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 5.30e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.10e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.77e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 9.80e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 5.28e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.76e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.42e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 7.03e-17 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.40e-17 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.60e-17 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 7.35e-18 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.28e-18 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.43e-18 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 6.05e-19 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.49e-19 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.00e-19 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.89e-20 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.50e-20 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 5.71e-21 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.67e-21 < 2.00e-07 : OK +evaluation of cube/slice for plotting OK true + +Test IO - type = double , ndim = 2 + +err = 0.00000000e+00 + test_io : 1223 : test_io : 0.00e+00 < 1.00e-12 : OK +test_io OK +Test compression of a normalized gaussian at origin, type = double , ndim = 3 + test_basic : 221 : norm : 2.11e-10 < 3.00e-10 : OK + test_basic : 222 : err : 2.05e-05 < 3.00e-05 : OK + test_basic : 223 : error at a point : 9.95e-07 < 1.00e-05 : OK + test_basic : 227 : new_norm : 4.44e-16 < 1.00e-14 : OK + test_basic : 232 : new_norm : 1.67e-15 < 1.00e-14 : OK + test_basic : 233 : new_err : 6.78e-21 < 1.00e-14 : OK + test_basic : 237 : new_norm : 1.89e-15 < 1.00e-14 : OK + test_basic : 242 : new_norm : 1.89e-15 < 1.00e-09 : OK + test_basic : 243 : new_err : 2.05e-05 < 3.00e-05 : OK +projection, compression, reconstruction, truncation OK true -msg= : - value=1 : line=1462 : function=await : filename='./src/madness/world/thread.h' -MADNESS: fatal error: caught a MADNESS exception -Abort(1) on node 0 (rank 0 in comm 0): application called MPI_Abort(MPI_COMM_WORLD, 1) - process 0 +Test convergence - log(err)/(n*k) should be roughly const, a least for each value of k + - type = double , ndim = 3 + +k=2 + n=1 err=2.07e-01 #coeff=6.40e+01 log(err)/(n*k)=7.89e-01 + n=2 err=1.11e+00 #coeff=5.12e+02 log(err)/(n*k)=2.51e-02 + n=3 err=5.20e-01 #coeff=4.10e+03 log(err)/(n*k)=1.09e-01 + n=4 err=9.46e-02 #coeff=3.28e+04 log(err)/(n*k)=2.95e-01 + n=5 err=4.29e-02 #coeff=2.62e+05 log(err)/(n*k)=3.15e-01 +k=3 + n=1 err=9.31e-01 #coeff=2.16e+02 log(err)/(n*k)=2.37e-02 + n=2 err=6.05e-01 #coeff=1.73e+03 log(err)/(n*k)=8.37e-02 + n=3 err=1.39e-01 #coeff=1.38e+04 log(err)/(n*k)=2.20e-01 + n=4 err=5.19e-02 #coeff=1.11e+05 log(err)/(n*k)=2.46e-01 + n=5 err=5.05e-03 #coeff=8.85e+05 log(err)/(n*k)=3.53e-01 +k=4 + n=1 err=6.54e-01 #coeff=5.12e+02 log(err)/(n*k)=1.06e-01 + n=2 err=2.41e-01 #coeff=4.10e+03 log(err)/(n*k)=1.78e-01 + n=3 err=1.06e-01 #coeff=3.28e+04 log(err)/(n*k)=1.87e-01 + n=4 err=3.26e-03 #coeff=2.62e+05 log(err)/(n*k)=3.58e-01 + n=5 err=5.18e-04 #coeff=2.10e+06 log(err)/(n*k)=3.78e-01 +k=5 + n=1 err=4.31e-01 #coeff=1.00e+03 log(err)/(n*k)=1.69e-01 + n=2 err=1.58e-01 #coeff=8.00e+03 log(err)/(n*k)=1.84e-01 + n=3 err=2.13e-02 #coeff=6.40e+04 log(err)/(n*k)=2.57e-01 + n=4 err=1.78e-03 #coeff=5.12e+05 log(err)/(n*k)=3.17e-01 + n=5 err=5.04e-05 #coeff=4.10e+06 log(err)/(n*k)=3.96e-01 +k=6 + n=1 err=2.21e-01 #coeff=1.73e+03 log(err)/(n*k)=2.51e-01 + n=2 err=1.18e-01 #coeff=1.38e+04 log(err)/(n*k)=1.78e-01 + n=3 err=8.37e-03 #coeff=1.11e+05 log(err)/(n*k)=2.66e-01 + n=4 err=2.15e-04 #coeff=8.85e+05 log(err)/(n*k)=3.52e-01 +k=7 + n=1 err=1.38e-01 #coeff=2.74e+03 log(err)/(n*k)=2.83e-01 + n=2 err=4.41e-02 #coeff=2.20e+04 log(err)/(n*k)=2.23e-01 + n=3 err=3.72e-03 #coeff=1.76e+05 log(err)/(n*k)=2.66e-01 + n=4 err=3.88e-05 #coeff=1.40e+06 log(err)/(n*k)=3.63e-01 +k=8 + n=1 err=1.34e-01 #coeff=4.10e+03 log(err)/(n*k)=2.51e-01 + n=2 err=1.53e-02 #coeff=3.28e+04 log(err)/(n*k)=2.61e-01 + n=3 err=3.09e-04 #coeff=2.62e+05 log(err)/(n*k)=3.37e-01 + n=4 err=6.69e-06 #coeff=2.10e+06 log(err)/(n*k)=3.72e-01 +k=9 + n=1 err=1.00e-01 #coeff=5.83e+03 log(err)/(n*k)=2.55e-01 + n=2 err=1.46e-02 #coeff=4.67e+04 log(err)/(n*k)=2.35e-01 + n=3 err=3.08e-04 #coeff=3.73e+05 log(err)/(n*k)=2.99e-01 + n=4 err=6.06e-07 #coeff=2.99e+06 log(err)/(n*k)=3.98e-01 +k=10 + n=1 err=5.43e-02 #coeff=8.00e+03 log(err)/(n*k)=2.91e-01 + n=2 err=6.18e-03 #coeff=6.40e+04 log(err)/(n*k)=2.54e-01 + n=3 err=5.19e-05 #coeff=5.12e+05 log(err)/(n*k)=3.29e-01 + n=4 err=1.50e-07 #coeff=4.10e+06 log(err)/(n*k)=3.93e-01 +k=11 + n=1 err=2.31e-02 #coeff=1.06e+04 log(err)/(n*k)=3.43e-01 + n=2 err=1.36e-03 #coeff=8.52e+04 log(err)/(n*k)=3.00e-01 + n=3 err=1.46e-05 #coeff=6.81e+05 log(err)/(n*k)=3.37e-01 + n=4 err=5.75e-09 #coeff=5.45e+06 log(err)/(n*k)=4.31e-01 +k=12 + n=1 err=1.82e-02 #coeff=1.38e+04 log(err)/(n*k)=3.34e-01 + n=2 err=1.36e-03 #coeff=1.11e+05 log(err)/(n*k)=2.75e-01 + n=3 err=4.99e-06 #coeff=8.85e+05 log(err)/(n*k)=3.39e-01 + n=4 err=2.60e-09 #coeff=7.08e+06 log(err)/(n*k)=4.12e-01 +k=13 + n=1 err=1.67e-02 #coeff=1.76e+04 log(err)/(n*k)=3.15e-01 + n=2 err=5.73e-04 #coeff=1.41e+05 log(err)/(n*k)=2.87e-01 + n=3 err=3.57e-07 #coeff=1.12e+06 log(err)/(n*k)=3.81e-01 + n=4 err=4.02e-11 #coeff=9.00e+06 log(err)/(n*k)=4.60e-01 +k=14 + n=1 err=1.04e-02 #coeff=2.20e+04 log(err)/(n*k)=3.26e-01 + n=2 err=1.06e-04 #coeff=1.76e+05 log(err)/(n*k)=3.27e-01 + n=3 err=2.96e-07 #coeff=1.40e+06 log(err)/(n*k)=3.58e-01 + n=4 err=3.58e-11 #coeff=1.12e+07 log(err)/(n*k)=4.30e-01 +k=15 + n=1 err=4.32e-03 #coeff=2.70e+04 log(err)/(n*k)=3.63e-01 + n=2 err=1.05e-04 #coeff=2.16e+05 log(err)/(n*k)=3.05e-01 + n=3 err=2.44e-08 #coeff=1.73e+06 log(err)/(n*k)=3.90e-01 + n=4 err=1.35e-12 #coeff=1.38e+07 log(err)/(n*k)=4.56e-01 +k=16 + n=1 err=2.21e-03 #coeff=3.28e+04 log(err)/(n*k)=3.82e-01 + n=2 err=3.85e-05 #coeff=2.62e+05 log(err)/(n*k)=3.18e-01 + n=3 err=1.22e-08 #coeff=2.10e+06 log(err)/(n*k)=3.80e-01 + n=4 err=4.00e-13 #coeff=1.68e+07 log(err)/(n*k)=4.46e-01 +k=17 + n=1 err=2.19e-03 #coeff=3.93e+04 log(err)/(n*k)=3.60e-01 + n=2 err=7.26e-06 #coeff=3.14e+05 log(err)/(n*k)=3.48e-01 + n=3 err=2.11e-09 #coeff=2.52e+06 log(err)/(n*k)=3.92e-01 + n=4 err=2.50e-14 #coeff=2.01e+07 log(err)/(n*k)=4.61e-01 +k=18 + n=1 err=1.44e-03 #coeff=4.67e+04 log(err)/(n*k)=3.63e-01 + n=2 err=6.88e-06 #coeff=3.73e+05 log(err)/(n*k)=3.30e-01 + n=3 err=3.51e-10 #coeff=2.99e+06 log(err)/(n*k)=4.03e-01 + n=4 err=4.48e-15 #coeff=2.39e+07 log(err)/(n*k)=4.59e-01 +k=19 + n=1 err=5.82e-04 #coeff=5.49e+04 log(err)/(n*k)=3.92e-01 + n=2 err=1.88e-06 #coeff=4.39e+05 log(err)/(n*k)=3.47e-01 + n=3 err=1.13e-10 #coeff=3.51e+06 log(err)/(n*k)=4.02e-01 + n=4 err=3.16e-15 #coeff=2.81e+07 log(err)/(n*k)=4.39e-01 +k=20 + n=1 err=2.60e-04 #coeff=6.40e+04 log(err)/(n*k)=4.13e-01 + n=2 err=5.18e-07 #coeff=5.12e+05 log(err)/(n*k)=3.62e-01 + n=3 err=5.90e-12 #coeff=4.10e+06 log(err)/(n*k)=4.31e-01 + n=4 err=4.30e-15 #coeff=3.28e+07 log(err)/(n*k)=4.14e-01 +k=21 + n=1 err=2.58e-04 #coeff=7.41e+04 log(err)/(n*k)=3.93e-01 + n=2 err=3.61e-07 #coeff=5.93e+05 log(err)/(n*k)=3.53e-01 + n=3 err=4.45e-12 #coeff=4.74e+06 log(err)/(n*k)=4.15e-01 + n=4 err=4.48e-15 #coeff=3.79e+07 log(err)/(n*k)=3.93e-01 +k=22 + n=1 err=1.59e-04 #coeff=8.52e+04 log(err)/(n*k)=3.98e-01 + n=2 err=6.25e-08 #coeff=6.81e+05 log(err)/(n*k)=3.77e-01 + n=3 err=2.30e-13 #coeff=5.45e+06 log(err)/(n*k)=4.41e-01 + n=4 err=4.56e-15 #coeff=4.36e+07 log(err)/(n*k)=3.75e-01 +k=23 + n=1 err=5.62e-05 #coeff=9.73e+04 log(err)/(n*k)=4.25e-01 + n=2 err=3.33e-08 #coeff=7.79e+05 log(err)/(n*k)=3.74e-01 + n=3 err=1.39e-13 #coeff=6.23e+06 log(err)/(n*k)=4.29e-01 + n=4 err=4.18e-15 #coeff=4.98e+07 log(err)/(n*k)=3.60e-01 +k=24 + n=1 err=2.96e-05 #coeff=1.11e+05 log(err)/(n*k)=4.35e-01 + n=2 err=1.44e-08 #coeff=8.85e+05 log(err)/(n*k)=3.76e-01 + n=3 err=1.59e-14 #coeff=7.08e+06 log(err)/(n*k)=4.41e-01 + n=4 err=3.23e-15 #coeff=5.66e+07 log(err)/(n*k)=3.48e-01 +k=25 + n=1 err=2.72e-05 #coeff=1.25e+05 log(err)/(n*k)=4.20e-01 + n=2 err=1.63e-09 #coeff=1.00e+06 log(err)/(n*k)=4.05e-01 + n=3 err=9.46e-15 #coeff=8.00e+06 log(err)/(n*k)=4.31e-01 + n=4 err=6.01e-15 #coeff=6.40e+07 log(err)/(n*k)=3.27e-01 +k=26 + n=1 err=1.39e-05 #coeff=1.41e+05 log(err)/(n*k)=4.30e-01 + n=2 err=1.63e-09 #coeff=1.12e+06 log(err)/(n*k)=3.89e-01 + n=3 err=9.07e-15 #coeff=9.00e+06 log(err)/(n*k)=4.15e-01 + n=4 err=6.68e-15 #coeff=7.20e+07 log(err)/(n*k)=3.14e-01 +k=27 + n=1 err=4.05e-06 #coeff=1.57e+05 log(err)/(n*k)=4.60e-01 + n=2 err=3.97e-10 #coeff=1.26e+06 log(err)/(n*k)=4.01e-01 + n=3 err=8.52e-15 #coeff=1.01e+07 log(err)/(n*k)=4.00e-01 + n=4 err=6.45e-15 #coeff=8.06e+07 log(err)/(n*k)=3.03e-01 +k=28 + n=1 err=3.31e-06 #coeff=1.76e+05 log(err)/(n*k)=4.51e-01 + n=2 err=9.69e-11 #coeff=1.40e+06 log(err)/(n*k)=4.12e-01 + n=3 err=9.23e-15 #coeff=1.12e+07 log(err)/(n*k)=3.85e-01 + n=4 err=7.04e-15 #coeff=8.99e+07 log(err)/(n*k)=2.91e-01 +k=29 + n=1 err=2.39e-06 #coeff=1.95e+05 log(err)/(n*k)=4.46e-01 + n=2 err=5.69e-11 #coeff=1.56e+06 log(err)/(n*k)=4.07e-01 + n=3 err=6.53e-15 #coeff=1.25e+07 log(err)/(n*k)=3.75e-01 + n=4 err=5.15e-15 #coeff=9.99e+07 log(err)/(n*k)=2.84e-01 +k=30 + n=1 err=8.82e-07 #coeff=2.16e+05 log(err)/(n*k)=4.65e-01 + n=2 err=6.39e-12 #coeff=1.73e+06 log(err)/(n*k)=4.30e-01 + n=3 err=8.58e-15 #coeff=1.38e+07 log(err)/(n*k)=3.60e-01 + n=4 err=6.29e-15 #coeff=1.11e+08 log(err)/(n*k)=2.72e-01 +test conv OK + + +Test basic math operations - type = double , ndim = 3 + + test_math : 367 : err in f before squaring : 2.88e-09 < 3.00e-09 : OK + test_math : 370 : err in f after squaring : 0.00e+00 < 2.88e-23 : OK + test_math : 372 : err in fsq : 2.14e-08 < 2.20e-08 : OK + test_math : 377 : err in unaryp_op negate : 7.13e-16 < 1.00e-10 : OK + test_math : 384 : err in unaryp_op square : 0.00e+00 < 1.00e-10 : OK + test_math : 427 :add scalar in place compressed : 5.51e-14 < 1.00e-12 : OK + test_math : 433 :in-place scaling reconstructed : 1.35e-13 < 1.00e-12 : OK + test_math : 439 : in-place scaling compressed : 8.10e-13 < 1.00e-12 : OK + test_math : 445 : in-place scaling (op) recon : 4.55e-12 < 1.00e-11 : OK + test_math : 451 : in-place scaling (op) comp : 4.27e-11 < 1.00e-10 : OK + test_math : 457 : err in fsq by multiplication : 2.14e-08 < 3.00e-08 : OK +nnn 1.00000000e+00 + test_math : 471 : general op unchanged input : 4.00e-22 < 1.00e-14 : OK + test_math : 473 : general op output : 1.25e-14 < 1.00e-13 : OK + +Test multiplying random functions + test 0 + test_math : 498 : err1 : 1.83e-09 < 1.00e-08 : OK + test_math : 499 : err2 : 3.87e-09 < 1.00e-08 : OK + test_math : 500 : err3 : 2.61e-14 < 1.00e-08 : OK + test 1 + test_math : 498 : err1 : 2.20e-09 < 1.00e-08 : OK + test_math : 499 : err2 : 1.36e-09 < 1.00e-08 : OK + test_math : 500 : err3 : 1.07e-100 < 1.00e-08 : OK + test 2 + test_math : 498 : err1 : 3.97e-09 < 1.00e-08 : OK + test_math : 499 : err2 : 1.04e-09 < 1.00e-08 : OK + test_math : 500 : err3 : 1.29e-12 < 1.00e-08 : OK + test 3 + test_math : 498 : err1 : 8.33e-10 < 1.00e-08 : OK + test_math : 499 : err2 : 4.36e-09 < 1.00e-08 : OK + test_math : 500 : err3 : 8.26e-17 < 1.00e-08 : OK + test 4 + test_math : 498 : err1 : 7.20e-10 < 1.00e-08 : OK + test_math : 499 : err2 : 1.02e-09 < 1.00e-08 : OK + test_math : 500 : err3 : 0.00e+00 < 1.00e-08 : OK + +Test multiplying a vector of random functions + test_math : 530 : err : 6.85e-15 < 1.00e-08 : OK + test_math : 530 : err : 6.35e-14 < 1.00e-08 : OK + test_math : 530 : err : 2.09e-20 < 1.00e-08 : OK + test_math : 530 : err : 1.52e-17 < 1.00e-08 : OK + test_math : 530 : err : 6.81e-17 < 1.00e-08 : OK + +Test refining down to a common level + +Test multioperation + +Test DONE multi 9.22710131e-14 + +Test adding random functions out of place + test 0 + test_math : 562 : err1 : 1.52e-09 < 1.00e-08 : OK + test_math : 563 : err2 : 8.05e-10 < 1.00e-08 : OK + test_math : 564 : err3 : 1.72e-09 < 1.00e-08 : OK + test 1 + test_math : 562 : err1 : 2.09e-09 < 1.00e-08 : OK + test_math : 563 : err2 : 2.69e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 3.42e-09 < 1.00e-08 : OK + test 2 + test_math : 562 : err1 : 3.85e-09 < 1.00e-08 : OK + test_math : 563 : err2 : 1.57e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 4.16e-09 < 1.00e-08 : OK + test 3 + test_math : 562 : err1 : 7.56e-10 < 1.00e-08 : OK + test_math : 563 : err2 : 8.78e-10 < 1.00e-08 : OK + test_math : 564 : err3 : 1.16e-09 < 1.00e-08 : OK + test 4 + test_math : 562 : err1 : 3.81e-09 < 1.00e-08 : OK + test_math : 563 : err2 : 4.32e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 5.78e-09 < 1.00e-08 : OK + test 5 + test_math : 562 : err1 : 4.06e-09 < 1.00e-08 : OK + test_math : 563 : err2 : 1.19e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 4.23e-09 < 1.00e-08 : OK + test 6 + test_math : 562 : err1 : 2.21e-09 < 1.00e-08 : OK + test_math : 563 : err2 : 1.34e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 2.59e-09 < 1.00e-08 : OK + test 7 + test_math : 562 : err1 : 8.46e-10 < 1.00e-08 : OK + test_math : 563 : err2 : 3.07e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 3.18e-09 < 1.00e-08 : OK + test 8 + test_math : 562 : err1 : 3.85e-09 < 1.00e-08 : OK + test_math : 563 : err2 : 2.36e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 4.52e-09 < 1.00e-08 : OK + test 9 + test_math : 562 : err1 : 9.23e-10 < 1.00e-08 : OK + test_math : 563 : err2 : 2.71e-09 < 1.00e-08 : OK + test_math : 564 : err3 : 2.87e-09 < 1.00e-08 : OK + +Test adding random functions in place + test 0 + test_math : 581 : err1 : 3.93e-09 < 1.00e-08 : OK + test_math : 582 : err2 : 2.17e-09 < 1.00e-08 : OK + test 1 + test_math : 581 : err1 : 5.56e-09 < 1.00e-08 : OK + test_math : 582 : err2 : 4.67e-09 < 1.00e-08 : OK + test 2 + test_math : 581 : err1 : 6.24e-09 < 1.00e-08 : OK + test_math : 582 : err2 : 4.21e-09 < 1.00e-08 : OK + test 3 + test_math : 581 : err1 : 4.66e-09 < 1.00e-08 : OK + test_math : 582 : err2 : 4.30e-09 < 1.00e-08 : OK + test 4 + test_math : 581 : err1 : 4.75e-09 < 1.00e-08 : OK + test_math : 582 : err2 : 3.79e-09 < 1.00e-08 : OK +true + +Test differentiation - type = double , ndim = 3 +note that differentiation does not preserve the accuracy +in this particular case the threshold in loosened by a factor of 40 + +timer: project 0.17s 0.17s +timer: compress 0.22s 0.22s +timer: truncate 0.03s 0.03s +timer: reconstruct 0.08s 0.08s +doing axis 0 +timer: diff 0.08s 0.08s +timer: err 0.06s 0.06s + test_diff : 660 : err in test_diff : 1.05e-08 < 1.10e-08 : OK + error 1.04688288e-08 +doing axis 1 +timer: diff 0.13s 0.13s +timer: err 0.06s 0.06s + test_diff : 660 : err in test_diff : 1.05e-08 < 1.10e-08 : OK + error 1.04688290e-08 +doing axis 2 +timer: diff 0.11s 0.11s +timer: err 0.08s 0.08s + test_diff : 660 : err in test_diff : 1.05e-08 < 1.10e-08 : OK + error 1.04688286e-08 + +Test separated operators - type = double , ndim = 3 + +test_rnlp OK +timer: project 0.24s 0.24s + f norm is 1.00000000e+00 + f total error 5.40466946e-10 +timer: apply 0.73s 0.73s + numeric at origin 6.17761821e-01 +analytic at origin 6.17761821e-01 + op*f norm is 1.65560026e-01 + op*f total error 9.87258981e-09 + test_op : 767 : err in test_op : 9.87e-09 < 3.00e-08 : OK + +Test Coulomb operator - type = double , ndim = 3 (only) + +timer: project 0.22s 0.22s + f norm is 7.96828940e+00 + f total error 3.50098300e-08 + test_coulomb : 845 : test_coulomb 1 : 3.50e-08 < 1.00e-07 : OK +timer: nonstandard 0.08s 0.08s + +before operator + +timer: apply 6.03s 6.03s +timer: reconstruct result 0.08s 0.08s + numeric at origin 1.12837917e+01 +analytic at origin 1.12837917e+01 + op*f norm is 1.23376952e+01 + op*f total error 1.21353196e-07 + test_coulomb : 901 : err in test_coulomb : 1.21e-07 < 1.00e-06 : OK + +Test plot cube - type = double , ndim = 3 + + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 6.88e-28 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.43e-27 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 7.80e-28 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.80e-28 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 8.49e-29 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.52e-28 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.13e-28 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.35e-28 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.03e-28 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.52e-28 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.64e-30 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 5.14e-29 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.88e-28 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.32e-28 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.91e-28 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.01e-28 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.32e-28 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.42e-27 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.81e-26 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 9.44e-26 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.95e-25 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.47e-24 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.15e-23 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.90e-23 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.90e-22 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 8.73e-12 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.69e-21 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 9.89e-21 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.25e-20 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.07e-19 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.31e-19 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 9.78e-19 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.79e-18 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 7.57e-18 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.99e-17 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.99e-17 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.19e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.75e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 6.08e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.28e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.61e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 5.07e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 9.44e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.68e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.87e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.69e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 7.33e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.09e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.55e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.10e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.70e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.30e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.80e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.10e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.13e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.76e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.00e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.89e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.95e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.01e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.47e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.70e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.61e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 5.10e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 5.17e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.90e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.36e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.67e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.93e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.23e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.62e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.12e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 7.41e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.69e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.84e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.65e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 9.20e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.91e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.52e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.24e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 5.85e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.65e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.15e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.82e-17 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.94e-17 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 7.45e-18 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.76e-18 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 9.28e-19 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.37e-19 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.11e-19 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.50e-20 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.07e-20 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.11e-21 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 8.74e-22 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.36e-22 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 6.12e-23 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.52e-23 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.73e-24 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.54e-25 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.26e-26 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.33e-24 < 2.00e-07 : OK +evaluation of cube/slice for plotting OK true + +Test IO - type = double , ndim = 3 + +err = 0.00000000e+00 + test_io : 1223 : test_io : 0.00e+00 < 1.00e-12 : OK +test_io OK + +Test plot cube - type = double , ndim = 4 + + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.66e-30 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.29e-32 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 8.66e-32 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.71e-32 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.75e-29 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 8.43e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.29e-21 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.81e-18 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.62e-16 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.79e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.06e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.17e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 2.89e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 4.39e-13 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 8.05e-14 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.33e-15 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 3.47e-17 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 9.21e-20 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 1.26e-22 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 6.13e-22 < 2.00e-07 : OK + test_plot : 1161 : eval_local_only : 0.00e+00 < 1.00e-12 : OK + test_plot : 1165 : plot-eval : 9.64e-21 < 2.00e-07 : OK +evaluation of cube/slice for plotting OK true +entering final fence +done with final fence + +Final tensor instance count 0 + + Parallel environment + -------------------- + #nodes 1 + #threads per node 127+main = 128 + #total threads 128 + + RMI message statistics (min / avg / max) + ---------------------- + #messages in server q 0.00e+00 / 0.00e+00 / 0.00e+00 + #messages sent per node 0.00e+00 / 0.00e+00 / 0.00e+00 + #bytes sent per node 0.00e+00 / 0.00e+00 / 0.00e+00 + #messages recv per node 0.00e+00 / 0.00e+00 / 0.00e+00 + #bytes recv per node 0.00e+00 / 0.00e+00 / 0.00e+00 + #msgs systemwide 0.00e+00 + #bytes systemwide 0.00e+00 + + Thread pool statistics (min / avg / max) + ---------------------- + #tasks per node 2.92e+06 / 2.92e+06 / 2.92e+06 + #max q len per node 1.42e+04 / 1.42e+04 / 1.42e+04 + #hi-pri tasks per node 3.28e+05 / 3.28e+05 / 3.28e+05 + + Total wall time 156.5s + Total cpu time 156.5s + +testsuite passed: true + test 48 Start 48: mra_sepop-testper @@ -8009,7 +10743,7 @@ 48: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra/testper 48: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/madness/mra 48: Test timeout computed to be: 1500 -48: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +48: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 48: [*] 56.41895835 48: [*] 10000.00000000 48: @@ -8114,7 +10848,7 @@ 48: 0.98 1.00000000 1.00134098 3.68e-03 48: 0.99 1.00000000 0.91527940 -6.07e-03 48: 1.00 1.00000000 0.47900442 -2.10e-02 -48/56 Test #48: mra_sepop-testper ....................... Passed 2.18 sec +48/56 Test #48: mra_sepop-testper ....................... Passed 3.80 sec test 49 Start 49: build_chem_unittests @@ -8527,14 +11261,14 @@ 49: gmake[4]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 49: gmake[3]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' 49: -49/56 Test #49: build_chem_unittests .................... Passed 245.81 sec +49/56 Test #49: build_chem_unittests .................... Passed 867.35 sec test 50 Start 50: chem-test_SCFOperators 50: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem/test_SCFOperators 50: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem 50: Test timeout computed to be: 1500 -50: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +50: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 50: small test : false 50: entering test_kinetic with dimension, type 1 d 50: 8.862269e-01 8.862272e-01 2.835025e-07 @@ -8561,29 +11295,29 @@ 50: 0.000000e+00 1.756205e+00 50: 0.000000e+00 1.756209e+00 50: 0.000000e+00 1.756209e+00 -50: 0.000000e+00 1.584156e+00 -50: 0.000000e+00 1.572524e+00 50: 0.000000e+00 1.572525e+00 -50: 0.000000e+00 7.855427e-01 +50: 0.000000e+00 1.584155e+00 +50: 0.000000e+00 1.572525e+00 +50: 0.000000e+00 7.854416e-01 50: 0.000000e+00 7.854444e-01 -50: 0.000000e+00 7.879491e-01 -50: a/symmetric algorithm error 1.110223e-16 +50: 0.000000e+00 7.855465e-01 +50: a/symmetric algorithm error 0.000000e+00 50: entering test_kinetic with dimension, type 3 d 50: 2.088123e+00 2.088130e+00 7.180624e-06 -50: : 8.700181e-02 -50: ff.norm2(), abs(ff.norms()) 1.806292e-01 1.806292e-01 1.806292e-01 +50: : 2.880079e-17 +50: ff.norm2(), abs(ff.norms()) 1.042863e-01 1.042863e-01 1.042863e-01 50: hermiticity error/translational invariance 50: abs err op(ij).normf() 50: 0.000000e+00 2.423686e+00 50: 0.000000e+00 2.423685e+00 50: 0.000000e+00 2.423688e+00 -50: 0.000000e+00 2.954033e+00 +50: 0.000000e+00 2.975555e+00 50: 0.000000e+00 2.954033e+00 50: 0.000000e+00 2.954034e+00 50: 0.000000e+00 1.230446e+00 50: 0.000000e+00 1.230447e+00 -50: 0.000000e+00 1.230451e+00 -50: a/symmetric algorithm error 3.330669e-16 +50: 0.000000e+00 1.230545e+00 +50: a/symmetric algorithm error 1.570092e-16 50: 50: entering test_coulomb 50: thresh 1.000000e-05 @@ -8593,15 +11327,15 @@ 50: element, refelement, error 1.419488e+00 1.419487e+00 1.237576e-07 50: hermiticity error/translational invariance 50: abs err op(ij).normf() -50: 1.341632e-18 2.822515e+00 +50: 2.914216e-17 2.822515e+00 50: 1.506033e-12 2.396730e+00 -50: 8.014341e-12 1.661708e+00 -50: 2.747662e-16 6.281618e+00 -50: 1.287966e-17 5.372221e+00 -50: 4.091296e-11 3.832495e+00 -50: 1.983099e-18 1.335820e+00 -50: 1.573205e-14 1.204648e+00 -50: 3.012651e-11 9.171227e-01 +50: 8.014611e-12 1.661708e+00 +50: 6.878258e-18 6.233835e+00 +50: 1.102305e-11 5.414726e+00 +50: 5.174429e-11 3.801220e+00 +50: 1.197885e-19 1.335810e+00 +50: 1.573266e-14 1.204648e+00 +50: 8.856597e-13 9.170496e-01 50: a/symmetric algorithm error 1.655203e-08 50: 50: entering test_exchange 1.000000e-05 d @@ -8610,16 +11344,16 @@ 50: diff in Kmat compared to hardwired result 1.884059e-07 50: hermiticity error/translational invariance 50: abs err op(ij).normf() -50: 5.160491e-18 2.370968e+00 +50: 6.027468e-17 2.370968e+00 50: 6.986471e-10 1.192815e+00 50: 1.427671e-10 2.093508e-01 -50: 2.566711e-11 6.001492e+00 +50: 2.902177e-17 5.960391e+00 50: 4.559073e-10 3.295791e+00 50: 1.867422e-10 5.588951e-01 -50: 1.529942e-19 2.263074e-01 -50: 1.943213e-10 3.040431e-01 +50: 2.335877e-20 2.263074e-01 +50: 3.196950e-10 3.043143e-01 50: 1.028689e-10 1.374549e-01 -50: a/symmetric algorithm error 2.777176e-10 +50: a/symmetric algorithm error 2.777177e-10 50: 50: entering test_XCOperator 1.000000e-06 50: xc functional lda 1.000000e-06 @@ -8704,7 +11438,7 @@ 50: ggatol 1.000000e-04 50: polarized false 50: -50: timer: Project vnuclear 0.56s 0.56s +50: timer: Project vnuclear 1.71s 1.71s 50: constructed nuclear correlation factor of the form 50: R = 1.000000e+00 50: with eprec 1.000000e-06 @@ -8734,7 +11468,7 @@ 50: ggatol 1.000000e-04 50: polarized false 50: -50: timer: Project vnuclear -202181.98s 0.61s +50: timer: Project vnuclear 1.24s 1.24s 50: constructed nuclear correlation factor of the form 50: R = 1.000000e+00 50: with eprec 1.000000e-05 @@ -8750,7 +11484,7 @@ 50: with eprec 1.000000e-05 50: which is of Slater type 50: -50: u2,u2ref -2.375810e+01 -2.375810e+01 6.745417e-09 +50: u2,u2ref -2.375810e+01 -2.375810e+01 6.745410e-09 50: u3,u3ref -5.782054e-04 -5.781745e-04 3.081496e-08 50: 50: u1x,u1xref, u1axis= 0 2.333449e-03 2.332607e-03 8.422544e-07 @@ -8768,7 +11502,7 @@ 50: u2x,u2xref, daxis= 2 4.579076e+00 4.579083e+00 6.886269e-06 50: u2x,u2xref, daxis= 0 8.528621e-01 8.528620e-01 4.701742e-08 50: u2x,u2xref, daxis= 1 -2.312786e-01 -2.312846e-01 6.014367e-06 -50: u2x,u2xref, daxis= 2 -8.257284e-16 0.000000e+00 8.257284e-16 +50: u2x,u2xref, daxis= 2 -8.881784e-16 0.000000e+00 8.881784e-16 50: 50: u3x,u3xref, daxis= 0 -1.241265e-03 -1.241050e-03 2.144408e-07 50: u3x,u3xref, daxis= 1 -3.208367e-04 -3.208126e-04 2.406897e-08 @@ -8890,7 +11624,7 @@ 50: 50: Solving NDIM= 3 with thresh 1.000000e-04 k 8 conv 1.000000e-04 50: -50: timer: Project vnuclear 0.38s 0.38s +50: timer: Project vnuclear 1.01s 1.01s 50: 50: constructed nuclear correlation factor of the form 50: S_A = 1/(a-1) exp(-a Z_A r_{1A}) + 1 @@ -8898,35 +11632,35 @@ 50: with eprec 1.000000e-06 50: which is of Slater type 50: -50: timer: reproject ncf 1.09s 1.09s -50: timer: guess density 0.20s 0.19s -50: timer: guess Coulomb potn 1.35s 1.35s -50: timer: guess lda potn 0.27s 0.27s -50: timer: guess overlap 0.08s 0.08s -50: timer: KEmat reconstruct 0.06s 0.06s -50: timer: KEmat differentiate 0.87s 0.87s -50: timer: KEmat compress 0.12s 0.12s -50: timer: KEmat inner products 0.20s 0.20s -50: timer: guess Kinet potn 1.27s 1.27s -50: timer: guess fock 0.46s 0.46s +50: timer: reproject ncf 2.69s 2.69s +50: timer: guess density 0.52s 0.52s +50: timer: guess Coulomb potn 3.69s 3.69s +50: timer: guess lda potn 0.64s 0.64s +50: timer: guess overlap 0.10s 0.10s +50: timer: KEmat reconstruct 0.12s 0.12s +50: timer: KEmat differentiate 0.86s 0.86s +50: timer: KEmat compress 0.60s 0.60s +50: timer: KEmat inner products 0.53s 0.53s +50: timer: guess Kinet potn 2.12s 2.12s +50: timer: guess fock 1.57s 1.57s 50: timer: guess eigen sol 0.00s 0.00s -50: timer: guess orbital groupi 0.08s 0.08s +50: timer: guess orbital groupi 0.25s 0.25s 50: -50: starting protocol at time 160.7s +50: starting protocol at time 344.0s 50: precision steps 1.000000e-04 --> 1.000000e-05 50: protocol: thresh 1.000000e-04 econv 1.000000e-04 dconv 1.000000e-03 50: -50: ending protocol at time 160.7s +50: ending protocol at time 344.0s 50: 50: Solving NDIM= 3 with thresh 1.000000e-04 k 8 conv 1.000000e-04 50: -50: timer: Boys localize 0.97s 0.97s +50: timer: Boys localize 2.51s 2.51s 50: orbital irreps [] 50: saving vector of functions nemo_it0 -50: timer: reconstruct psi 0.09s 0.09s -50: timer: compute Jnemo 1.42s 1.42s -50: timer: compute Knemo 3.36s 3.36s -50: timer: compute Unemo 0.0084 1.74s 1.74s +50: timer: reconstruct psi 0.22s 0.22s +50: timer: compute Jnemo 4.31s 4.31s +50: timer: compute Knemo 7.85s 7.85s +50: timer: compute Unemo 0.0084 3.80s 3.80s 50: 50: nuclear and kinetic -14.08868330 50: coulomb 6.69224417 @@ -8934,25 +11668,25 @@ 50: nuclear-repulsion 2.08695652 50: regularized energy -7.64190377 50: buggy if hybrid functionals are used.. -50: timer: compute energy 1.48s 1.48s +50: timer: compute energy 4.16s 4.15s 50: [-7.641904e+00, -1.408868e+01, 6.692244e+00, 0.000000e+00, -2.332421e+00, 0.000000e+00, 2.086957e+00] 50: [] 50: energy differences 2.645751e+00 -50: timer: make Vpsi 0.11s 0.11s +50: timer: make Vpsi 0.46s 0.46s 50: timer: transform Vpsi 0.04s 0.04s -50: timer: apply BSH 1.08s 1.08s +50: timer: apply BSH 2.56s 2.56s 50: norm of nemo and GVnemo; ratio 1.254213e+00 1.333517e+00 9.405303e-01 50: Norm of vector changes ab spin case : rms 8.753289e-02 max 1.224964e-01 -50: finished iteration 0 at time 174.8s with energy -7.64190377 +50: finished iteration 0 at time 377.2s with energy -7.64190377 50: current residual norm 1.181509e-01 50: -50: timer: Boys localize 1.03s 1.03s +50: timer: Boys localize 2.68s 2.68s 50: orbital irreps [] 50: saving vector of functions nemo_it1 -50: timer: reconstruct psi 0.10s 0.10s -50: timer: compute Jnemo 1.52s 1.52s -50: timer: compute Knemo 202190.98s 3.17s -50: timer: compute Unemo 0.0066 1.44s 1.33s +50: timer: reconstruct psi 0.37s 0.37s +50: timer: compute Jnemo 3.74s 3.74s +50: timer: compute Knemo 6.93s 6.93s +50: timer: compute Unemo 0.0066 3.01s 3.01s 50: 50: nuclear and kinetic -13.98180598 50: coulomb 6.46498280 @@ -8960,25 +11694,25 @@ 50: nuclear-repulsion 2.08695652 50: regularized energy -7.69733945 50: buggy if hybrid functionals are used.. -50: timer: compute energy 1.30s 1.21s +50: timer: compute energy 2.01s 2.01s 50: [-7.697339e+00, -1.398181e+01, 6.464983e+00, 0.000000e+00, -2.267473e+00, 0.000000e+00, 2.086957e+00] 50: [-7.641904e+00, -1.408868e+01, 6.692244e+00, 0.000000e+00, -2.332421e+00, 0.000000e+00, 2.086957e+00] 50: energy differences 2.652582e-01 -50: timer: make Vpsi 0.09s 0.09s -50: timer: transform Vpsi 0.03s 0.03s -50: timer: apply BSH 1.06s 0.98s +50: timer: make Vpsi 0.15s 0.15s +50: timer: transform Vpsi 0.04s 0.04s +50: timer: apply BSH 1.87s 1.87s 50: norm of nemo and GVnemo; ratio 1.265009e+00 1.271342e+00 9.950193e-01 50: Norm of vector changes ab spin case : rms 2.739713e-02 max 3.615801e-02 -50: finished iteration 1 at time 187.2s with energy -7.69733945 +50: finished iteration 1 at time 404.1s with energy -7.69733945 50: current residual norm 2.380522e-02 50: -50: timer: Boys localize 0.99s 0.92s +50: timer: Boys localize 2.40s 2.40s 50: orbital irreps [] 50: saving vector of functions nemo_it2 -50: timer: reconstruct psi 0.11s 0.10s -50: timer: compute Jnemo 1.50s 1.39s -50: timer: compute Knemo 3.07s 2.85s -50: timer: compute Unemo 0.0065 1.34s 1.24s +50: timer: reconstruct psi 0.65s 0.65s +50: timer: compute Jnemo 3.58s 3.58s +50: timer: compute Knemo 6.42s 6.42s +50: timer: compute Unemo 0.0065 2.92s 2.92s 50: 50: nuclear and kinetic -13.97656549 50: coulomb 6.44435091 @@ -8986,25 +11720,25 @@ 50: nuclear-repulsion 2.08695652 50: regularized energy -7.70304214 50: buggy if hybrid functionals are used.. -50: timer: compute energy 1.20s 1.20s +50: timer: compute energy 3.68s 3.68s 50: [-7.703042e+00, -1.397657e+01, 6.444351e+00, 0.000000e+00, -2.257784e+00, 0.000000e+00, 2.086957e+00] 50: [-7.697339e+00, -1.398181e+01, 6.464983e+00, 0.000000e+00, -2.267473e+00, 0.000000e+00, 2.086957e+00] 50: energy differences 2.407342e-02 -50: timer: make Vpsi 0.09s 0.09s -50: timer: transform Vpsi 0.04s 0.04s -50: timer: apply BSH 1.07s 1.07s +50: timer: make Vpsi 0.19s 0.19s +50: timer: transform Vpsi 0.05s 0.05s +50: timer: apply BSH 2.22s 2.22s 50: norm of nemo and GVnemo; ratio 1.266347e+00 1.268490e+00 9.983101e-01 50: Norm of vector changes ab spin case : rms 1.652156e-02 max 2.272013e-02 -50: finished iteration 2 at time 199.4s with energy -7.70304214 +50: finished iteration 2 at time 431.8s with energy -7.70304214 50: current residual norm 9.503438e-03 50: -50: timer: Boys localize 0.86s 0.86s +50: timer: Boys localize 2.18s 2.18s 50: orbital irreps [] 50: saving vector of functions nemo_it3 -50: timer: reconstruct psi 0.17s 0.17s -50: timer: compute Jnemo 1.41s 1.41s -50: timer: compute Knemo 3.25s 3.25s -50: timer: compute Unemo 0.0065 1.54s 1.54s +50: timer: reconstruct psi 0.24s 0.24s +50: timer: compute Jnemo 3.10s 3.10s +50: timer: compute Knemo 6.43s 6.43s +50: timer: compute Unemo 0.0065 3.13s 3.13s 50: 50: nuclear and kinetic -13.96360872 50: coulomb 6.42197921 @@ -9012,25 +11746,25 @@ 50: nuclear-repulsion 2.08695652 50: regularized energy -7.70371832 50: buggy if hybrid functionals are used.. -50: timer: compute energy 1.36s 1.36s +50: timer: compute energy 2.94s 2.94s 50: [-7.703718e+00, -1.396361e+01, 6.421979e+00, 0.000000e+00, -2.249045e+00, 0.000000e+00, 2.086957e+00] 50: [-7.703042e+00, -1.397657e+01, 6.444351e+00, 0.000000e+00, -2.257784e+00, 0.000000e+00, 2.086957e+00] 50: energy differences 2.729824e-02 -50: timer: make Vpsi 0.09s 0.09s +50: timer: make Vpsi 0.14s 0.14s 50: timer: transform Vpsi 0.04s 0.04s -50: timer: apply BSH 0.92s 0.92s +50: timer: apply BSH 1.98s 1.98s 50: norm of nemo and GVnemo; ratio 1.267293e+00 1.267071e+00 1.000175e+00 50: Norm of vector changes ab spin case : rms 3.234865e-03 max 4.445415e-03 -50: finished iteration 3 at time 212.5s with energy -7.70371832 +50: finished iteration 3 at time 458.4s with energy -7.70371832 50: current residual norm 2.315478e-03 50: -50: timer: Boys localize 0.97s 0.97s +50: timer: Boys localize 2.11s 2.11s 50: orbital irreps [] 50: saving vector of functions nemo_it4 -50: timer: reconstruct psi 0.18s 0.18s -50: timer: compute Jnemo 1.39s 1.39s -50: timer: compute Knemo 2.88s 2.88s -50: timer: compute Unemo 0.0066 1.38s 1.38s +50: timer: reconstruct psi 0.38s 0.38s +50: timer: compute Jnemo 3.07s 3.07s +50: timer: compute Knemo 6.51s 6.51s +50: timer: compute Unemo 0.0066 2.75s 2.75s 50: 50: nuclear and kinetic -13.96316434 50: coulomb 6.42107659 @@ -9038,25 +11772,25 @@ 50: nuclear-repulsion 2.08695652 50: regularized energy -7.70375663 50: buggy if hybrid functionals are used.. -50: timer: compute energy 1.33s 1.33s +50: timer: compute energy 2.42s 2.42s 50: [-7.703757e+00, -1.396316e+01, 6.421077e+00, 0.000000e+00, -2.248625e+00, 0.000000e+00, 2.086957e+00] 50: [-7.703718e+00, -1.396361e+01, 6.421979e+00, 0.000000e+00, -2.249045e+00, 0.000000e+00, 2.086957e+00] 50: energy differences 1.090865e-03 -50: timer: make Vpsi 0.11s 0.11s -50: timer: transform Vpsi 0.02s 0.02s -50: timer: apply BSH 0.89s 0.89s +50: timer: make Vpsi 0.21s 0.21s +50: timer: transform Vpsi 0.01s 0.01s +50: timer: apply BSH 1.85s 1.85s 50: norm of nemo and GVnemo; ratio 1.267255e+00 1.267307e+00 9.999592e-01 50: Norm of vector changes ab spin case : rms 2.492079e-03 max 3.456196e-03 -50: finished iteration 4 at time 225.4s with energy -7.70375663 +50: finished iteration 4 at time 483.7s with energy -7.70375663 50: current residual norm 1.061793e-03 50: -50: timer: Boys localize 0.84s 0.84s +50: timer: Boys localize 1.88s 1.88s 50: orbital irreps [] 50: saving vector of functions nemo_it5 -50: timer: reconstruct psi 0.13s 0.13s -50: timer: compute Jnemo 1.45s 1.45s -50: timer: compute Knemo 3.13s 3.13s -50: timer: compute Unemo 0.0066 1.31s 1.31s +50: timer: reconstruct psi 0.30s 0.30s +50: timer: compute Jnemo 3.04s 3.04s +50: timer: compute Knemo 6.74s 6.74s +50: timer: compute Unemo 0.0066 2.41s 2.41s 50: 50: nuclear and kinetic -13.96269793 50: coulomb 6.42039679 @@ -9064,16 +11798,16 @@ 50: nuclear-repulsion 2.08695652 50: regularized energy -7.70376211 50: buggy if hybrid functionals are used.. -50: timer: compute energy 1.34s 1.34s +50: timer: compute energy 2.62s 2.62s 50: [-7.703762e+00, -1.396270e+01, 6.420397e+00, 0.000000e+00, -2.248417e+00, 0.000000e+00, 2.086957e+00] 50: [-7.703757e+00, -1.396316e+01, 6.421077e+00, 0.000000e+00, -2.248625e+00, 0.000000e+00, 2.086957e+00] 50: energy differences 8.502505e-04 -50: timer: make Vpsi 0.11s 0.11s -50: timer: transform Vpsi 0.02s 0.02s -50: timer: apply BSH 0.91s 0.91s +50: timer: make Vpsi 0.12s 0.12s +50: timer: transform Vpsi 0.06s 0.06s +50: timer: apply BSH 2.38s 2.38s 50: norm of nemo and GVnemo; ratio 1.267257e+00 1.267387e+00 9.998980e-01 50: Norm of vector changes ab spin case : rms 1.156972e-03 max 1.599103e-03 -50: finished iteration 5 at time 237.8s with energy -7.70376211 +50: finished iteration 5 at time 509.4s with energy -7.70376211 50: current residual norm 4.787442e-04 50: 50: @@ -9081,19 +11815,19 @@ 50: 50: protocol: thresh 1.000000e-05 econv 1.000000e-05 dconv 1.000000e-04 50: -50: ending protocol at time 237.8s +50: ending protocol at time 509.4s 50: 50: Solving NDIM= 3 with thresh 1.000000e-05 k 8 conv 1.000000e-04 50: -50: timer: Project vnuclear 0.61s 0.57s -50: timer: reproject ncf 1.48s 1.38s -50: timer: Boys localize 1.19s 1.11s +50: timer: Project vnuclear 1.13s 1.13s +50: timer: reproject ncf 2.82s 2.82s +50: timer: Boys localize 1.99s 1.99s 50: orbital irreps [] 50: saving vector of functions nemo_it0 -50: timer: reconstruct psi 0.22s 0.20s -50: timer: compute Jnemo 2.37s 2.20s -50: timer: compute Knemo 4.34s 4.03s -50: timer: compute Unemo 0.0083 -202191.36s 1.62s +50: timer: reconstruct psi 0.57s 0.57s +50: timer: compute Jnemo 4.54s 4.54s +50: timer: compute Knemo 8.97s 8.97s +50: timer: compute Unemo 0.0083 3.38s 3.38s 50: 50: nuclear and kinetic -13.96262876 50: coulomb 6.42051954 @@ -9101,25 +11835,25 @@ 50: nuclear-repulsion 2.08695652 50: regularized energy -7.70376783 50: buggy if hybrid functionals are used.. -50: timer: compute energy 1.72s 1.72s +50: timer: compute energy 2.50s 2.50s 50: [-7.703768e+00, -1.396263e+01, 6.420520e+00, 0.000000e+00, -2.248615e+00, 0.000000e+00, 2.086957e+00] 50: [] 50: energy differences 2.645751e+00 -50: timer: make Vpsi 0.08s 0.08s -50: timer: transform Vpsi 0.06s 0.06s -50: timer: apply BSH 1.68s 1.68s +50: timer: make Vpsi 0.15s 0.15s +50: timer: transform Vpsi 0.03s 0.03s +50: timer: apply BSH 2.98s 2.98s 50: norm of nemo and GVnemo; ratio 1.267262e+00 1.267366e+00 9.999186e-01 50: Norm of vector changes ab spin case : rms 2.678340e-04 max 3.341488e-04 -50: finished iteration 0 at time 256.8s with energy -7.70376783 +50: finished iteration 0 at time 545.3s with energy -7.70376783 50: current residual norm 2.822050e-04 50: -50: timer: Boys localize 1.05s 1.04s +50: timer: Boys localize 2.44s 2.44s 50: orbital irreps [] 50: saving vector of functions nemo_it1 -50: timer: reconstruct psi 0.13s 0.13s -50: timer: compute Jnemo 2.09s 2.09s -50: timer: compute Knemo 4.48s 4.48s -50: timer: compute Unemo 0.0083 1.63s 1.63s +50: timer: reconstruct psi 0.36s 0.36s +50: timer: compute Jnemo 5.04s 5.04s +50: timer: compute Knemo 8.47s 8.47s +50: timer: compute Unemo 0.0083 2.54s 2.54s 50: 50: nuclear and kinetic -13.96248412 50: coulomb 6.42019093 @@ -9127,32 +11861,68 @@ 50: nuclear-repulsion 2.08695652 50: regularized energy -7.70383527 50: buggy if hybrid functionals are used.. -50: timer: compute energy 1.71s 1.71s +50: timer: compute energy 3.41s 3.41s 50: [-7.703835e+00, -1.396248e+01, 6.420191e+00, 0.000000e+00, -2.248499e+00, 0.000000e+00, 2.086957e+00] 50: [-7.703768e+00, -1.396263e+01, 6.420520e+00, 0.000000e+00, -2.248615e+00, 0.000000e+00, 2.086957e+00] 50: energy differences 3.834452e-04 -50: timer: make Vpsi 0.13s 0.13s +50: timer: make Vpsi 0.31s 0.31s 50: timer: transform Vpsi 0.04s 0.04s -50: timer: apply BSH 1.82s 1.82s +50: timer: apply BSH 3.35s 3.35s 50: norm of nemo and GVnemo; ratio 1.267274e+00 1.267307e+00 9.999743e-01 50: Norm of vector changes ab spin case : rms 1.762192e-04 max 2.395964e-04 -50: finished iteration 1 at time 273.8s with energy -7.70383527 +50: finished iteration 1 at time 577.3s with energy -7.70383527 50: current residual norm 1.288193e-04 50: -50: timer: Boys localize 1.28s 1.28s +50: timer: Boys localize 2.52s 2.52s 50: orbital irreps [] 50: saving vector of functions nemo_it2 -50: timer: reconstruct psi 0.26s 0.26s -50: !!MADNESS: Hung queue? -50: !!MADNESS: Hung queue? -50: !!MADNESS: Hung queue? -50: !!MADNESS: Hung queue? -50: !!MADNESS: Hung queue? -50: !!MADNESS ERROR: Exception thrown in WorldTaskQueue::fence() with 3 pending task(s) -50: terminate called after throwing an instance of 'madness::MadnessException' -50: what(): ThreadPool::await() timed out after 900.0 seconds -50/56 Test #50: chem-test_SCFOperators ..................Subprocess aborted***Exception: 278.85 sec -MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +50: timer: reconstruct psi 0.30s 0.30s +50: timer: compute Jnemo 4.65s 4.65s +50: timer: compute Knemo 8.43s 8.43s +50: timer: compute Unemo 0.0083 2.39s 2.39s +50: +50: nuclear and kinetic -13.96240443 +50: coulomb 6.42007371 +50: exchange -2.24846138 +50: nuclear-repulsion 2.08695652 +50: regularized energy -7.70383558 +50: buggy if hybrid functionals are used.. +50: timer: compute energy 2.97s 2.97s +50: [-7.703836e+00, -1.396240e+01, 6.420074e+00, 0.000000e+00, -2.248461e+00, 0.000000e+00, 2.086957e+00] +50: [-7.703835e+00, -1.396248e+01, 6.420191e+00, 0.000000e+00, -2.248499e+00, 0.000000e+00, 2.086957e+00] +50: energy differences 1.465588e-04 +50: timer: make Vpsi 0.18s 0.18s +50: timer: transform Vpsi 0.06s 0.06s +50: timer: apply BSH 3.00s 3.00s +50: norm of nemo and GVnemo; ratio 1.267279e+00 1.267300e+00 9.999839e-01 +50: Norm of vector changes ab spin case : rms 1.564782e-04 max 2.153923e-04 +50: finished iteration 2 at time 608.0s with energy -7.70383558 +50: current residual norm 7.087364e-05 +50: +50: +50: Iterations converged +50: +50: +50: ending protocol at time 608.0s +50: +50: Dipole Moment (a.u.) +50: ----------- +50: +50: x: -1.916948e+00 +50: y: 4.005001e-13 +50: z: 3.259677e-13 +50: Total Dipole Moment: 1.916948e+00 +50: +50: timer: dipole 0.17s 0.17s +50: Nemo Orbital Energies: [*] -2.46579798 -0.34379191 +50: +50: energy(LiH) -7.703836e+00 +50: +50: tests passed +50: +50: MADNESS runtime finalized but 1 world still exists +50/56 Test #50: chem-test_SCFOperators ..................***Timeout 1501.59 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 small test : false entering test_kinetic with dimension, type 1 d 8.862269e-01 8.862272e-01 2.835025e-07 @@ -9179,29 +11949,29 @@ 0.000000e+00 1.756205e+00 0.000000e+00 1.756209e+00 0.000000e+00 1.756209e+00 -0.000000e+00 1.584156e+00 -0.000000e+00 1.572524e+00 0.000000e+00 1.572525e+00 -0.000000e+00 7.855427e-01 +0.000000e+00 1.584155e+00 +0.000000e+00 1.572525e+00 +0.000000e+00 7.854416e-01 0.000000e+00 7.854444e-01 -0.000000e+00 7.879491e-01 -a/symmetric algorithm error 1.110223e-16 +0.000000e+00 7.855465e-01 +a/symmetric algorithm error 0.000000e+00 entering test_kinetic with dimension, type 3 d 2.088123e+00 2.088130e+00 7.180624e-06 - : 8.700181e-02 -ff.norm2(), abs(ff.norms()) 1.806292e-01 1.806292e-01 1.806292e-01 + : 2.880079e-17 +ff.norm2(), abs(ff.norms()) 1.042863e-01 1.042863e-01 1.042863e-01 hermiticity error/translational invariance abs err op(ij).normf() 0.000000e+00 2.423686e+00 0.000000e+00 2.423685e+00 0.000000e+00 2.423688e+00 -0.000000e+00 2.954033e+00 +0.000000e+00 2.975555e+00 0.000000e+00 2.954033e+00 0.000000e+00 2.954034e+00 0.000000e+00 1.230446e+00 0.000000e+00 1.230447e+00 -0.000000e+00 1.230451e+00 -a/symmetric algorithm error 3.330669e-16 +0.000000e+00 1.230545e+00 +a/symmetric algorithm error 1.570092e-16 entering test_coulomb thresh 1.000000e-05 @@ -9211,15 +11981,15 @@ element, refelement, error 1.419488e+00 1.419487e+00 1.237576e-07 hermiticity error/translational invariance abs err op(ij).normf() -1.341632e-18 2.822515e+00 +2.914216e-17 2.822515e+00 1.506033e-12 2.396730e+00 -8.014341e-12 1.661708e+00 -2.747662e-16 6.281618e+00 -1.287966e-17 5.372221e+00 -4.091296e-11 3.832495e+00 -1.983099e-18 1.335820e+00 -1.573205e-14 1.204648e+00 -3.012651e-11 9.171227e-01 +8.014611e-12 1.661708e+00 +6.878258e-18 6.233835e+00 +1.102305e-11 5.414726e+00 +5.174429e-11 3.801220e+00 +1.197885e-19 1.335810e+00 +1.573266e-14 1.204648e+00 +8.856597e-13 9.170496e-01 a/symmetric algorithm error 1.655203e-08 entering test_exchange 1.000000e-05 d @@ -9228,16 +11998,16 @@ diff in Kmat compared to hardwired result 1.884059e-07 hermiticity error/translational invariance abs err op(ij).normf() -5.160491e-18 2.370968e+00 +6.027468e-17 2.370968e+00 6.986471e-10 1.192815e+00 1.427671e-10 2.093508e-01 -2.566711e-11 6.001492e+00 +2.902177e-17 5.960391e+00 4.559073e-10 3.295791e+00 1.867422e-10 5.588951e-01 -1.529942e-19 2.263074e-01 -1.943213e-10 3.040431e-01 +2.335877e-20 2.263074e-01 +3.196950e-10 3.043143e-01 1.028689e-10 1.374549e-01 -a/symmetric algorithm error 2.777176e-10 +a/symmetric algorithm error 2.777177e-10 entering test_XCOperator 1.000000e-06 xc functional lda 1.000000e-06 @@ -9322,7 +12092,7 @@ ggatol 1.000000e-04 polarized false -timer: Project vnuclear 0.56s 0.56s +timer: Project vnuclear 1.71s 1.71s constructed nuclear correlation factor of the form R = 1.000000e+00 with eprec 1.000000e-06 @@ -9352,7 +12122,7 @@ ggatol 1.000000e-04 polarized false -timer: Project vnuclear -202181.98s 0.61s +timer: Project vnuclear 1.24s 1.24s constructed nuclear correlation factor of the form R = 1.000000e+00 with eprec 1.000000e-05 @@ -9368,7 +12138,7 @@ with eprec 1.000000e-05 which is of Slater type -u2,u2ref -2.375810e+01 -2.375810e+01 6.745417e-09 +u2,u2ref -2.375810e+01 -2.375810e+01 6.745410e-09 u3,u3ref -5.782054e-04 -5.781745e-04 3.081496e-08 u1x,u1xref, u1axis= 0 2.333449e-03 2.332607e-03 8.422544e-07 @@ -9386,7 +12156,7 @@ u2x,u2xref, daxis= 2 4.579076e+00 4.579083e+00 6.886269e-06 u2x,u2xref, daxis= 0 8.528621e-01 8.528620e-01 4.701742e-08 u2x,u2xref, daxis= 1 -2.312786e-01 -2.312846e-01 6.014367e-06 -u2x,u2xref, daxis= 2 -8.257284e-16 0.000000e+00 8.257284e-16 +u2x,u2xref, daxis= 2 -8.881784e-16 0.000000e+00 8.881784e-16 u3x,u3xref, daxis= 0 -1.241265e-03 -1.241050e-03 2.144408e-07 u3x,u3xref, daxis= 1 -3.208367e-04 -3.208126e-04 2.406897e-08 @@ -9508,7 +12278,7 @@ Solving NDIM= 3 with thresh 1.000000e-04 k 8 conv 1.000000e-04 -timer: Project vnuclear 0.38s 0.38s +timer: Project vnuclear 1.01s 1.01s constructed nuclear correlation factor of the form S_A = 1/(a-1) exp(-a Z_A r_{1A}) + 1 @@ -9516,35 +12286,35 @@ with eprec 1.000000e-06 which is of Slater type -timer: reproject ncf 1.09s 1.09s -timer: guess density 0.20s 0.19s -timer: guess Coulomb potn 1.35s 1.35s -timer: guess lda potn 0.27s 0.27s -timer: guess overlap 0.08s 0.08s -timer: KEmat reconstruct 0.06s 0.06s -timer: KEmat differentiate 0.87s 0.87s -timer: KEmat compress 0.12s 0.12s -timer: KEmat inner products 0.20s 0.20s -timer: guess Kinet potn 1.27s 1.27s -timer: guess fock 0.46s 0.46s +timer: reproject ncf 2.69s 2.69s +timer: guess density 0.52s 0.52s +timer: guess Coulomb potn 3.69s 3.69s +timer: guess lda potn 0.64s 0.64s +timer: guess overlap 0.10s 0.10s +timer: KEmat reconstruct 0.12s 0.12s +timer: KEmat differentiate 0.86s 0.86s +timer: KEmat compress 0.60s 0.60s +timer: KEmat inner products 0.53s 0.53s +timer: guess Kinet potn 2.12s 2.12s +timer: guess fock 1.57s 1.57s timer: guess eigen sol 0.00s 0.00s -timer: guess orbital groupi 0.08s 0.08s +timer: guess orbital groupi 0.25s 0.25s -starting protocol at time 160.7s +starting protocol at time 344.0s precision steps 1.000000e-04 --> 1.000000e-05 protocol: thresh 1.000000e-04 econv 1.000000e-04 dconv 1.000000e-03 -ending protocol at time 160.7s +ending protocol at time 344.0s Solving NDIM= 3 with thresh 1.000000e-04 k 8 conv 1.000000e-04 -timer: Boys localize 0.97s 0.97s +timer: Boys localize 2.51s 2.51s orbital irreps [] saving vector of functions nemo_it0 -timer: reconstruct psi 0.09s 0.09s -timer: compute Jnemo 1.42s 1.42s -timer: compute Knemo 3.36s 3.36s -timer: compute Unemo 0.0084 1.74s 1.74s +timer: reconstruct psi 0.22s 0.22s +timer: compute Jnemo 4.31s 4.31s +timer: compute Knemo 7.85s 7.85s +timer: compute Unemo 0.0084 3.80s 3.80s nuclear and kinetic -14.08868330 coulomb 6.69224417 @@ -9552,25 +12322,25 @@ nuclear-repulsion 2.08695652 regularized energy -7.64190377 buggy if hybrid functionals are used.. -timer: compute energy 1.48s 1.48s +timer: compute energy 4.16s 4.15s [-7.641904e+00, -1.408868e+01, 6.692244e+00, 0.000000e+00, -2.332421e+00, 0.000000e+00, 2.086957e+00] [] energy differences 2.645751e+00 -timer: make Vpsi 0.11s 0.11s +timer: make Vpsi 0.46s 0.46s timer: transform Vpsi 0.04s 0.04s -timer: apply BSH 1.08s 1.08s +timer: apply BSH 2.56s 2.56s norm of nemo and GVnemo; ratio 1.254213e+00 1.333517e+00 9.405303e-01 Norm of vector changes ab spin case : rms 8.753289e-02 max 1.224964e-01 -finished iteration 0 at time 174.8s with energy -7.64190377 +finished iteration 0 at time 377.2s with energy -7.64190377 current residual norm 1.181509e-01 -timer: Boys localize 1.03s 1.03s +timer: Boys localize 2.68s 2.68s orbital irreps [] saving vector of functions nemo_it1 -timer: reconstruct psi 0.10s 0.10s -timer: compute Jnemo 1.52s 1.52s -timer: compute Knemo 202190.98s 3.17s -timer: compute Unemo 0.0066 1.44s 1.33s +timer: reconstruct psi 0.37s 0.37s +timer: compute Jnemo 3.74s 3.74s +timer: compute Knemo 6.93s 6.93s +timer: compute Unemo 0.0066 3.01s 3.01s nuclear and kinetic -13.98180598 coulomb 6.46498280 @@ -9578,25 +12348,25 @@ nuclear-repulsion 2.08695652 regularized energy -7.69733945 buggy if hybrid functionals are used.. -timer: compute energy 1.30s 1.21s +timer: compute energy 2.01s 2.01s [-7.697339e+00, -1.398181e+01, 6.464983e+00, 0.000000e+00, -2.267473e+00, 0.000000e+00, 2.086957e+00] [-7.641904e+00, -1.408868e+01, 6.692244e+00, 0.000000e+00, -2.332421e+00, 0.000000e+00, 2.086957e+00] energy differences 2.652582e-01 -timer: make Vpsi 0.09s 0.09s -timer: transform Vpsi 0.03s 0.03s -timer: apply BSH 1.06s 0.98s +timer: make Vpsi 0.15s 0.15s +timer: transform Vpsi 0.04s 0.04s +timer: apply BSH 1.87s 1.87s norm of nemo and GVnemo; ratio 1.265009e+00 1.271342e+00 9.950193e-01 Norm of vector changes ab spin case : rms 2.739713e-02 max 3.615801e-02 -finished iteration 1 at time 187.2s with energy -7.69733945 +finished iteration 1 at time 404.1s with energy -7.69733945 current residual norm 2.380522e-02 -timer: Boys localize 0.99s 0.92s +timer: Boys localize 2.40s 2.40s orbital irreps [] saving vector of functions nemo_it2 -timer: reconstruct psi 0.11s 0.10s -timer: compute Jnemo 1.50s 1.39s -timer: compute Knemo 3.07s 2.85s -timer: compute Unemo 0.0065 1.34s 1.24s +timer: reconstruct psi 0.65s 0.65s +timer: compute Jnemo 3.58s 3.58s +timer: compute Knemo 6.42s 6.42s +timer: compute Unemo 0.0065 2.92s 2.92s nuclear and kinetic -13.97656549 coulomb 6.44435091 @@ -9604,25 +12374,25 @@ nuclear-repulsion 2.08695652 regularized energy -7.70304214 buggy if hybrid functionals are used.. -timer: compute energy 1.20s 1.20s +timer: compute energy 3.68s 3.68s [-7.703042e+00, -1.397657e+01, 6.444351e+00, 0.000000e+00, -2.257784e+00, 0.000000e+00, 2.086957e+00] [-7.697339e+00, -1.398181e+01, 6.464983e+00, 0.000000e+00, -2.267473e+00, 0.000000e+00, 2.086957e+00] energy differences 2.407342e-02 -timer: make Vpsi 0.09s 0.09s -timer: transform Vpsi 0.04s 0.04s -timer: apply BSH 1.07s 1.07s +timer: make Vpsi 0.19s 0.19s +timer: transform Vpsi 0.05s 0.05s +timer: apply BSH 2.22s 2.22s norm of nemo and GVnemo; ratio 1.266347e+00 1.268490e+00 9.983101e-01 Norm of vector changes ab spin case : rms 1.652156e-02 max 2.272013e-02 -finished iteration 2 at time 199.4s with energy -7.70304214 +finished iteration 2 at time 431.8s with energy -7.70304214 current residual norm 9.503438e-03 -timer: Boys localize 0.86s 0.86s +timer: Boys localize 2.18s 2.18s orbital irreps [] saving vector of functions nemo_it3 -timer: reconstruct psi 0.17s 0.17s -timer: compute Jnemo 1.41s 1.41s -timer: compute Knemo 3.25s 3.25s -timer: compute Unemo 0.0065 1.54s 1.54s +timer: reconstruct psi 0.24s 0.24s +timer: compute Jnemo 3.10s 3.10s +timer: compute Knemo 6.43s 6.43s +timer: compute Unemo 0.0065 3.13s 3.13s nuclear and kinetic -13.96360872 coulomb 6.42197921 @@ -9630,25 +12400,25 @@ nuclear-repulsion 2.08695652 regularized energy -7.70371832 buggy if hybrid functionals are used.. -timer: compute energy 1.36s 1.36s +timer: compute energy 2.94s 2.94s [-7.703718e+00, -1.396361e+01, 6.421979e+00, 0.000000e+00, -2.249045e+00, 0.000000e+00, 2.086957e+00] [-7.703042e+00, -1.397657e+01, 6.444351e+00, 0.000000e+00, -2.257784e+00, 0.000000e+00, 2.086957e+00] energy differences 2.729824e-02 -timer: make Vpsi 0.09s 0.09s +timer: make Vpsi 0.14s 0.14s timer: transform Vpsi 0.04s 0.04s -timer: apply BSH 0.92s 0.92s +timer: apply BSH 1.98s 1.98s norm of nemo and GVnemo; ratio 1.267293e+00 1.267071e+00 1.000175e+00 Norm of vector changes ab spin case : rms 3.234865e-03 max 4.445415e-03 -finished iteration 3 at time 212.5s with energy -7.70371832 +finished iteration 3 at time 458.4s with energy -7.70371832 current residual norm 2.315478e-03 -timer: Boys localize 0.97s 0.97s +timer: Boys localize 2.11s 2.11s orbital irreps [] saving vector of functions nemo_it4 -timer: reconstruct psi 0.18s 0.18s -timer: compute Jnemo 1.39s 1.39s -timer: compute Knemo 2.88s 2.88s -timer: compute Unemo 0.0066 1.38s 1.38s +timer: reconstruct psi 0.38s 0.38s +timer: compute Jnemo 3.07s 3.07s +timer: compute Knemo 6.51s 6.51s +timer: compute Unemo 0.0066 2.75s 2.75s nuclear and kinetic -13.96316434 coulomb 6.42107659 @@ -9656,25 +12426,25 @@ nuclear-repulsion 2.08695652 regularized energy -7.70375663 buggy if hybrid functionals are used.. -timer: compute energy 1.33s 1.33s +timer: compute energy 2.42s 2.42s [-7.703757e+00, -1.396316e+01, 6.421077e+00, 0.000000e+00, -2.248625e+00, 0.000000e+00, 2.086957e+00] [-7.703718e+00, -1.396361e+01, 6.421979e+00, 0.000000e+00, -2.249045e+00, 0.000000e+00, 2.086957e+00] energy differences 1.090865e-03 -timer: make Vpsi 0.11s 0.11s -timer: transform Vpsi 0.02s 0.02s -timer: apply BSH 0.89s 0.89s +timer: make Vpsi 0.21s 0.21s +timer: transform Vpsi 0.01s 0.01s +timer: apply BSH 1.85s 1.85s norm of nemo and GVnemo; ratio 1.267255e+00 1.267307e+00 9.999592e-01 Norm of vector changes ab spin case : rms 2.492079e-03 max 3.456196e-03 -finished iteration 4 at time 225.4s with energy -7.70375663 +finished iteration 4 at time 483.7s with energy -7.70375663 current residual norm 1.061793e-03 -timer: Boys localize 0.84s 0.84s +timer: Boys localize 1.88s 1.88s orbital irreps [] saving vector of functions nemo_it5 -timer: reconstruct psi 0.13s 0.13s -timer: compute Jnemo 1.45s 1.45s -timer: compute Knemo 3.13s 3.13s -timer: compute Unemo 0.0066 1.31s 1.31s +timer: reconstruct psi 0.30s 0.30s +timer: compute Jnemo 3.04s 3.04s +timer: compute Knemo 6.74s 6.74s +timer: compute Unemo 0.0066 2.41s 2.41s nuclear and kinetic -13.96269793 coulomb 6.42039679 @@ -9682,16 +12452,16 @@ nuclear-repulsion 2.08695652 regularized energy -7.70376211 buggy if hybrid functionals are used.. -timer: compute energy 1.34s 1.34s +timer: compute energy 2.62s 2.62s [-7.703762e+00, -1.396270e+01, 6.420397e+00, 0.000000e+00, -2.248417e+00, 0.000000e+00, 2.086957e+00] [-7.703757e+00, -1.396316e+01, 6.421077e+00, 0.000000e+00, -2.248625e+00, 0.000000e+00, 2.086957e+00] energy differences 8.502505e-04 -timer: make Vpsi 0.11s 0.11s -timer: transform Vpsi 0.02s 0.02s -timer: apply BSH 0.91s 0.91s +timer: make Vpsi 0.12s 0.12s +timer: transform Vpsi 0.06s 0.06s +timer: apply BSH 2.38s 2.38s norm of nemo and GVnemo; ratio 1.267257e+00 1.267387e+00 9.998980e-01 Norm of vector changes ab spin case : rms 1.156972e-03 max 1.599103e-03 -finished iteration 5 at time 237.8s with energy -7.70376211 +finished iteration 5 at time 509.4s with energy -7.70376211 current residual norm 4.787442e-04 @@ -9699,19 +12469,19 @@ protocol: thresh 1.000000e-05 econv 1.000000e-05 dconv 1.000000e-04 -ending protocol at time 237.8s +ending protocol at time 509.4s Solving NDIM= 3 with thresh 1.000000e-05 k 8 conv 1.000000e-04 -timer: Project vnuclear 0.61s 0.57s -timer: reproject ncf 1.48s 1.38s -timer: Boys localize 1.19s 1.11s +timer: Project vnuclear 1.13s 1.13s +timer: reproject ncf 2.82s 2.82s +timer: Boys localize 1.99s 1.99s orbital irreps [] saving vector of functions nemo_it0 -timer: reconstruct psi 0.22s 0.20s -timer: compute Jnemo 2.37s 2.20s -timer: compute Knemo 4.34s 4.03s -timer: compute Unemo 0.0083 -202191.36s 1.62s +timer: reconstruct psi 0.57s 0.57s +timer: compute Jnemo 4.54s 4.54s +timer: compute Knemo 8.97s 8.97s +timer: compute Unemo 0.0083 3.38s 3.38s nuclear and kinetic -13.96262876 coulomb 6.42051954 @@ -9719,25 +12489,25 @@ nuclear-repulsion 2.08695652 regularized energy -7.70376783 buggy if hybrid functionals are used.. -timer: compute energy 1.72s 1.72s +timer: compute energy 2.50s 2.50s [-7.703768e+00, -1.396263e+01, 6.420520e+00, 0.000000e+00, -2.248615e+00, 0.000000e+00, 2.086957e+00] [] energy differences 2.645751e+00 -timer: make Vpsi 0.08s 0.08s -timer: transform Vpsi 0.06s 0.06s -timer: apply BSH 1.68s 1.68s +timer: make Vpsi 0.15s 0.15s +timer: transform Vpsi 0.03s 0.03s +timer: apply BSH 2.98s 2.98s norm of nemo and GVnemo; ratio 1.267262e+00 1.267366e+00 9.999186e-01 Norm of vector changes ab spin case : rms 2.678340e-04 max 3.341488e-04 -finished iteration 0 at time 256.8s with energy -7.70376783 +finished iteration 0 at time 545.3s with energy -7.70376783 current residual norm 2.822050e-04 -timer: Boys localize 1.05s 1.04s +timer: Boys localize 2.44s 2.44s orbital irreps [] saving vector of functions nemo_it1 -timer: reconstruct psi 0.13s 0.13s -timer: compute Jnemo 2.09s 2.09s -timer: compute Knemo 4.48s 4.48s -timer: compute Unemo 0.0083 1.63s 1.63s +timer: reconstruct psi 0.36s 0.36s +timer: compute Jnemo 5.04s 5.04s +timer: compute Knemo 8.47s 8.47s +timer: compute Unemo 0.0083 2.54s 2.54s nuclear and kinetic -13.96248412 coulomb 6.42019093 @@ -9745,30 +12515,66 @@ nuclear-repulsion 2.08695652 regularized energy -7.70383527 buggy if hybrid functionals are used.. -timer: compute energy 1.71s 1.71s +timer: compute energy 3.41s 3.41s [-7.703835e+00, -1.396248e+01, 6.420191e+00, 0.000000e+00, -2.248499e+00, 0.000000e+00, 2.086957e+00] [-7.703768e+00, -1.396263e+01, 6.420520e+00, 0.000000e+00, -2.248615e+00, 0.000000e+00, 2.086957e+00] energy differences 3.834452e-04 -timer: make Vpsi 0.13s 0.13s +timer: make Vpsi 0.31s 0.31s timer: transform Vpsi 0.04s 0.04s -timer: apply BSH 1.82s 1.82s +timer: apply BSH 3.35s 3.35s norm of nemo and GVnemo; ratio 1.267274e+00 1.267307e+00 9.999743e-01 Norm of vector changes ab spin case : rms 1.762192e-04 max 2.395964e-04 -finished iteration 1 at time 273.8s with energy -7.70383527 +finished iteration 1 at time 577.3s with energy -7.70383527 current residual norm 1.288193e-04 -timer: Boys localize 1.28s 1.28s +timer: Boys localize 2.52s 2.52s orbital irreps [] saving vector of functions nemo_it2 -timer: reconstruct psi 0.26s 0.26s -!!MADNESS: Hung queue? -!!MADNESS: Hung queue? -!!MADNESS: Hung queue? -!!MADNESS: Hung queue? -!!MADNESS: Hung queue? -!!MADNESS ERROR: Exception thrown in WorldTaskQueue::fence() with 3 pending task(s) -terminate called after throwing an instance of 'madness::MadnessException' - what(): ThreadPool::await() timed out after 900.0 seconds +timer: reconstruct psi 0.30s 0.30s +timer: compute Jnemo 4.65s 4.65s +timer: compute Knemo 8.43s 8.43s +timer: compute Unemo 0.0083 2.39s 2.39s + + nuclear and kinetic -13.96240443 + coulomb 6.42007371 + exchange -2.24846138 + nuclear-repulsion 2.08695652 + regularized energy -7.70383558 + buggy if hybrid functionals are used.. +timer: compute energy 2.97s 2.97s +[-7.703836e+00, -1.396240e+01, 6.420074e+00, 0.000000e+00, -2.248461e+00, 0.000000e+00, 2.086957e+00] +[-7.703835e+00, -1.396248e+01, 6.420191e+00, 0.000000e+00, -2.248499e+00, 0.000000e+00, 2.086957e+00] +energy differences 1.465588e-04 +timer: make Vpsi 0.18s 0.18s +timer: transform Vpsi 0.06s 0.06s +timer: apply BSH 3.00s 3.00s +norm of nemo and GVnemo; ratio 1.267279e+00 1.267300e+00 9.999839e-01 +Norm of vector changes ab spin case : rms 1.564782e-04 max 2.153923e-04 +finished iteration 2 at time 608.0s with energy -7.70383558 +current residual norm 7.087364e-05 + + +Iterations converged + + +ending protocol at time 608.0s + + Dipole Moment (a.u.) + ----------- + + x: -1.916948e+00 + y: 4.005001e-13 + z: 3.259677e-13 + Total Dipole Moment: 1.916948e+00 + +timer: dipole 0.17s 0.17s +Nemo Orbital Energies: [*] -2.46579798 -0.34379191 + +energy(LiH) -7.703836e+00 + +tests passed + +MADNESS runtime finalized but 1 world still exists test 51 Start 51: chem-test_dft @@ -9776,7 +12582,7 @@ 51: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem/test_dft 51: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem 51: Test timeout computed to be: 1500 -51: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +51: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 51: xc energy: -2.466562e-03 51: xc energy via potential: -2.466562e-03 51: ratio 1.000000e+00 @@ -9786,14 +12592,25 @@ 51: tests passed 51: 51: MADNESS runtime finalized but 1 world still exists -51/56 Test #51: chem-test_dft ........................... Passed 3.49 sec +51/56 Test #51: chem-test_dft ...........................***Timeout 1500.32 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +xc energy: -2.466562e-03 +xc energy via potential: -2.466562e-03 +ratio 1.000000e+00 +xc energy via kernel: -2.466561e-03 +ratio 1.000000e+00 + +tests passed + +MADNESS runtime finalized but 1 world still exists + test 52 Start 52: chem-test_pointgroupsymmetry 52: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem/test_pointgroupsymmetry 52: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem 52: Test timeout computed to be: 1500 -52: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +52: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 52: test operator multiplications 2D 52: .. all good 52: test operator multiplications 3D @@ -9806,160 +12623,160 @@ 52: point group cs 52: irrep a' 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm sigma_xy 1 2.264992e-16 +52: operator, character, norm sigma_xy 1 2.266450e-16 52: irrep a'' 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm sigma_xy -1 2.173311e-16 +52: operator, character, norm sigma_xy -1 2.173062e-16 52: point group c2 52: irrep a 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) 1 2.821238e-16 +52: operator, character, norm C_2(z) 1 2.818952e-16 52: irrep b 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) -1 2.904374e-16 +52: operator, character, norm C_2(z) -1 2.902846e-16 52: point group ci 52: irrep ag 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm inversion 1 3.124129e-16 +52: operator, character, norm inversion 1 3.123030e-16 52: irrep au 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm inversion -1 3.152614e-16 +52: operator, character, norm inversion -1 3.152003e-16 52: point group c2v 52: irrep a1 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) 1 2.874069e-16 -52: operator, character, norm sigma_xz 1 2.437269e-16 -52: operator, character, norm sigma_yz 1 2.416838e-16 +52: operator, character, norm C_2(z) 1 2.872364e-16 +52: operator, character, norm sigma_xz 1 2.435904e-16 +52: operator, character, norm sigma_yz 1 2.416222e-16 52: irrep a2 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) 1 2.934386e-16 -52: operator, character, norm sigma_xz -1 2.075750e-16 -52: operator, character, norm sigma_yz -1 2.614180e-16 +52: operator, character, norm C_2(z) 1 2.934391e-16 +52: operator, character, norm sigma_xz -1 2.074019e-16 +52: operator, character, norm sigma_yz -1 2.614075e-16 52: irrep b1 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) -1 2.662010e-16 -52: operator, character, norm sigma_xz 1 2.035567e-16 -52: operator, character, norm sigma_yz -1 2.309062e-16 +52: operator, character, norm C_2(z) -1 2.660263e-16 +52: operator, character, norm sigma_xz 1 2.026588e-16 +52: operator, character, norm sigma_yz -1 2.307213e-16 52: irrep b2 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) -1 3.126780e-16 -52: operator, character, norm sigma_xz -1 2.259306e-16 -52: operator, character, norm sigma_yz 1 2.825109e-16 +52: operator, character, norm C_2(z) -1 3.128876e-16 +52: operator, character, norm sigma_xz -1 2.257795e-16 +52: operator, character, norm sigma_yz 1 2.828708e-16 52: point group c2h 52: irrep ag 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) 1 2.861880e-16 -52: operator, character, norm inversion 1 3.292778e-16 -52: operator, character, norm sigma_xy 1 2.270687e-16 +52: operator, character, norm C_2(z) 1 2.860313e-16 +52: operator, character, norm inversion 1 3.292653e-16 +52: operator, character, norm sigma_xy 1 2.270167e-16 52: irrep bg 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) -1 2.900722e-16 -52: operator, character, norm inversion 1 3.224864e-16 -52: operator, character, norm sigma_xy -1 2.125734e-16 +52: operator, character, norm C_2(z) -1 2.899658e-16 +52: operator, character, norm inversion 1 3.224409e-16 +52: operator, character, norm sigma_xy -1 2.124900e-16 52: irrep au 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) 1 2.871122e-16 -52: operator, character, norm inversion -1 3.219381e-16 -52: operator, character, norm sigma_xy -1 2.173035e-16 +52: operator, character, norm C_2(z) 1 2.870865e-16 +52: operator, character, norm inversion -1 3.219470e-16 +52: operator, character, norm sigma_xy -1 2.172626e-16 52: irrep bu 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) -1 2.983355e-16 -52: operator, character, norm inversion -1 3.283253e-16 -52: operator, character, norm sigma_xy 1 2.243634e-16 +52: operator, character, norm C_2(z) -1 2.983287e-16 +52: operator, character, norm inversion -1 3.283996e-16 +52: operator, character, norm sigma_xy 1 2.244829e-16 52: point group d2 52: irrep a1 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) 1 2.850989e-16 -52: operator, character, norm C_2(y) 1 2.959709e-16 -52: operator, character, norm C_2(x) 1 2.925185e-16 +52: operator, character, norm C_2(z) 1 2.848319e-16 +52: operator, character, norm C_2(y) 1 2.958525e-16 +52: operator, character, norm C_2(x) 1 2.922966e-16 52: irrep b1 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) 1 2.862259e-16 -52: operator, character, norm C_2(y) -1 2.915031e-16 -52: operator, character, norm C_2(x) -1 2.915404e-16 +52: operator, character, norm C_2(z) 1 2.859503e-16 +52: operator, character, norm C_2(y) -1 2.913730e-16 +52: operator, character, norm C_2(x) -1 2.913198e-16 52: irrep b2 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) -1 2.792792e-16 -52: operator, character, norm C_2(y) 1 2.956837e-16 -52: operator, character, norm C_2(x) -1 2.769140e-16 +52: operator, character, norm C_2(z) -1 2.790801e-16 +52: operator, character, norm C_2(y) 1 2.956277e-16 +52: operator, character, norm C_2(x) -1 2.767813e-16 52: irrep b3 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) -1 2.820942e-16 -52: operator, character, norm C_2(y) -1 2.969137e-16 -52: operator, character, norm C_2(x) 1 2.772195e-16 +52: operator, character, norm C_2(z) -1 2.818958e-16 +52: operator, character, norm C_2(y) -1 2.968616e-16 +52: operator, character, norm C_2(x) 1 2.770520e-16 52: point group d2h 52: irrep ag 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) 1 2.911524e-16 -52: operator, character, norm C_2(y) 1 2.879913e-16 -52: operator, character, norm C_2(x) 1 2.949978e-16 -52: operator, character, norm inversion 1 3.344831e-16 -52: operator, character, norm sigma_xy 1 2.232070e-16 -52: operator, character, norm sigma_xz 1 2.539833e-16 -52: operator, character, norm sigma_yz 1 2.498936e-16 +52: operator, character, norm C_2(z) 1 2.912474e-16 +52: operator, character, norm C_2(y) 1 2.879975e-16 +52: operator, character, norm C_2(x) 1 2.949714e-16 +52: operator, character, norm inversion 1 3.344909e-16 +52: operator, character, norm sigma_xy 1 2.233357e-16 +52: operator, character, norm sigma_xz 1 2.538378e-16 +52: operator, character, norm sigma_yz 1 2.501920e-16 52: irrep au 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) 1 2.864727e-16 -52: operator, character, norm C_2(y) 1 3.078820e-16 -52: operator, character, norm C_2(x) 1 2.841473e-16 -52: operator, character, norm inversion -1 3.396937e-16 -52: operator, character, norm sigma_xy -1 2.493493e-16 -52: operator, character, norm sigma_xz -1 2.110691e-16 -52: operator, character, norm sigma_yz -1 2.576022e-16 +52: operator, character, norm C_2(z) 1 2.863636e-16 +52: operator, character, norm C_2(y) 1 3.077931e-16 +52: operator, character, norm C_2(x) 1 2.838850e-16 +52: operator, character, norm inversion -1 3.396012e-16 +52: operator, character, norm sigma_xy -1 2.492307e-16 +52: operator, character, norm sigma_xz -1 2.108379e-16 +52: operator, character, norm sigma_yz -1 2.575528e-16 52: irrep b1g 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) 1 2.897806e-16 -52: operator, character, norm C_2(y) -1 3.060410e-16 -52: operator, character, norm C_2(x) -1 2.826706e-16 -52: operator, character, norm inversion 1 3.387803e-16 -52: operator, character, norm sigma_xy 1 2.428500e-16 -52: operator, character, norm sigma_xz -1 2.126851e-16 -52: operator, character, norm sigma_yz -1 2.563851e-16 +52: operator, character, norm C_2(z) 1 2.894955e-16 +52: operator, character, norm C_2(y) -1 3.059930e-16 +52: operator, character, norm C_2(x) -1 2.820691e-16 +52: operator, character, norm inversion 1 3.386283e-16 +52: operator, character, norm sigma_xy 1 2.425163e-16 +52: operator, character, norm sigma_xz -1 2.124835e-16 +52: operator, character, norm sigma_yz -1 2.562957e-16 52: irrep b1u 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) 1 2.871124e-16 -52: operator, character, norm C_2(y) -1 2.682419e-16 -52: operator, character, norm C_2(x) -1 2.798492e-16 -52: operator, character, norm inversion -1 3.130574e-16 -52: operator, character, norm sigma_xy -1 1.969353e-16 -52: operator, character, norm sigma_xz 1 2.398629e-16 -52: operator, character, norm sigma_yz 1 2.379920e-16 +52: operator, character, norm C_2(z) 1 2.870570e-16 +52: operator, character, norm C_2(y) -1 2.682686e-16 +52: operator, character, norm C_2(x) -1 2.798381e-16 +52: operator, character, norm inversion -1 3.129936e-16 +52: operator, character, norm sigma_xy -1 1.969029e-16 +52: operator, character, norm sigma_xz 1 2.397942e-16 +52: operator, character, norm sigma_yz 1 2.380155e-16 52: irrep b2g 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) -1 2.594594e-16 -52: operator, character, norm C_2(y) 1 2.634096e-16 -52: operator, character, norm C_2(x) -1 2.638296e-16 -52: operator, character, norm inversion 1 3.024125e-16 -52: operator, character, norm sigma_xy -1 2.140210e-16 -52: operator, character, norm sigma_xz 1 2.095583e-16 -52: operator, character, norm sigma_yz -1 2.225183e-16 +52: operator, character, norm C_2(z) -1 2.594145e-16 +52: operator, character, norm C_2(y) 1 2.633829e-16 +52: operator, character, norm C_2(x) -1 2.638078e-16 +52: operator, character, norm inversion 1 3.023601e-16 +52: operator, character, norm sigma_xy -1 2.139971e-16 +52: operator, character, norm sigma_xz 1 2.095492e-16 +52: operator, character, norm sigma_yz -1 2.225854e-16 52: irrep b2u 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) -1 3.156364e-16 -52: operator, character, norm C_2(y) 1 3.247882e-16 -52: operator, character, norm C_2(x) -1 2.882258e-16 -52: operator, character, norm inversion -1 3.491818e-16 -52: operator, character, norm sigma_xy 1 2.359012e-16 -52: operator, character, norm sigma_xz -1 2.401249e-16 -52: operator, character, norm sigma_yz 1 2.945857e-16 +52: operator, character, norm C_2(z) -1 3.156545e-16 +52: operator, character, norm C_2(y) 1 3.248113e-16 +52: operator, character, norm C_2(x) -1 2.882059e-16 +52: operator, character, norm inversion -1 3.491268e-16 +52: operator, character, norm sigma_xy 1 2.359339e-16 +52: operator, character, norm sigma_xz -1 2.400474e-16 +52: operator, character, norm sigma_yz 1 2.947311e-16 52: irrep b3g 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) -1 3.086077e-16 -52: operator, character, norm C_2(y) -1 3.145007e-16 -52: operator, character, norm C_2(x) 1 2.836653e-16 -52: operator, character, norm inversion 1 3.586584e-16 -52: operator, character, norm sigma_xy -1 2.459155e-16 -52: operator, character, norm sigma_xz -1 2.464762e-16 -52: operator, character, norm sigma_yz 1 2.960174e-16 +52: operator, character, norm C_2(z) -1 3.085651e-16 +52: operator, character, norm C_2(y) -1 3.145232e-16 +52: operator, character, norm C_2(x) 1 2.837117e-16 +52: operator, character, norm inversion 1 3.585469e-16 +52: operator, character, norm sigma_xy -1 2.460759e-16 +52: operator, character, norm sigma_xz -1 2.462714e-16 +52: operator, character, norm sigma_yz 1 2.961680e-16 52: irrep b3u 52: operator, character, norm identity 1 0.000000e+00 -52: operator, character, norm C_2(z) -1 2.620978e-16 -52: operator, character, norm C_2(y) -1 2.749488e-16 -52: operator, character, norm C_2(x) 1 2.651714e-16 -52: operator, character, norm inversion -1 3.025536e-16 -52: operator, character, norm sigma_xy 1 2.234678e-16 -52: operator, character, norm sigma_xz 1 2.019262e-16 -52: operator, character, norm sigma_yz -1 2.334226e-16 +52: operator, character, norm C_2(z) -1 2.622458e-16 +52: operator, character, norm C_2(y) -1 2.753597e-16 +52: operator, character, norm C_2(x) 1 2.656874e-16 +52: operator, character, norm inversion -1 3.029825e-16 +52: operator, character, norm sigma_xy 1 2.240609e-16 +52: operator, character, norm sigma_xz 1 2.019326e-16 +52: operator, character, norm sigma_yz -1 2.335727e-16 52: .. all good 52: point group c1 52: sym_equiv.size() 1 @@ -10010,30 +12827,258 @@ 52: .. all good 52: result 0 52: MADNESS runtime finalized but 1 world still exists -52/56 Test #52: chem-test_pointgroupsymmetry ............ Passed 33.26 sec +52/56 Test #52: chem-test_pointgroupsymmetry ............***Timeout 1500.41 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +test operator multiplications 2D + .. all good +test operator multiplications 3D + .. all good +test multiplication table c2v + .. all good +point group c1 + irrep a + operator, character, norm identity 1 0.000000e+00 +point group cs + irrep a' + operator, character, norm identity 1 0.000000e+00 + operator, character, norm sigma_xy 1 2.266450e-16 + irrep a'' + operator, character, norm identity 1 0.000000e+00 + operator, character, norm sigma_xy -1 2.173062e-16 +point group c2 + irrep a + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) 1 2.818952e-16 + irrep b + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) -1 2.902846e-16 +point group ci + irrep ag + operator, character, norm identity 1 0.000000e+00 + operator, character, norm inversion 1 3.123030e-16 + irrep au + operator, character, norm identity 1 0.000000e+00 + operator, character, norm inversion -1 3.152003e-16 +point group c2v + irrep a1 + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) 1 2.872364e-16 + operator, character, norm sigma_xz 1 2.435904e-16 + operator, character, norm sigma_yz 1 2.416222e-16 + irrep a2 + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) 1 2.934391e-16 + operator, character, norm sigma_xz -1 2.074019e-16 + operator, character, norm sigma_yz -1 2.614075e-16 + irrep b1 + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) -1 2.660263e-16 + operator, character, norm sigma_xz 1 2.026588e-16 + operator, character, norm sigma_yz -1 2.307213e-16 + irrep b2 + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) -1 3.128876e-16 + operator, character, norm sigma_xz -1 2.257795e-16 + operator, character, norm sigma_yz 1 2.828708e-16 +point group c2h + irrep ag + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) 1 2.860313e-16 + operator, character, norm inversion 1 3.292653e-16 + operator, character, norm sigma_xy 1 2.270167e-16 + irrep bg + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) -1 2.899658e-16 + operator, character, norm inversion 1 3.224409e-16 + operator, character, norm sigma_xy -1 2.124900e-16 + irrep au + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) 1 2.870865e-16 + operator, character, norm inversion -1 3.219470e-16 + operator, character, norm sigma_xy -1 2.172626e-16 + irrep bu + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) -1 2.983287e-16 + operator, character, norm inversion -1 3.283996e-16 + operator, character, norm sigma_xy 1 2.244829e-16 +point group d2 + irrep a1 + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) 1 2.848319e-16 + operator, character, norm C_2(y) 1 2.958525e-16 + operator, character, norm C_2(x) 1 2.922966e-16 + irrep b1 + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) 1 2.859503e-16 + operator, character, norm C_2(y) -1 2.913730e-16 + operator, character, norm C_2(x) -1 2.913198e-16 + irrep b2 + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) -1 2.790801e-16 + operator, character, norm C_2(y) 1 2.956277e-16 + operator, character, norm C_2(x) -1 2.767813e-16 + irrep b3 + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) -1 2.818958e-16 + operator, character, norm C_2(y) -1 2.968616e-16 + operator, character, norm C_2(x) 1 2.770520e-16 +point group d2h + irrep ag + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) 1 2.912474e-16 + operator, character, norm C_2(y) 1 2.879975e-16 + operator, character, norm C_2(x) 1 2.949714e-16 + operator, character, norm inversion 1 3.344909e-16 + operator, character, norm sigma_xy 1 2.233357e-16 + operator, character, norm sigma_xz 1 2.538378e-16 + operator, character, norm sigma_yz 1 2.501920e-16 + irrep au + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) 1 2.863636e-16 + operator, character, norm C_2(y) 1 3.077931e-16 + operator, character, norm C_2(x) 1 2.838850e-16 + operator, character, norm inversion -1 3.396012e-16 + operator, character, norm sigma_xy -1 2.492307e-16 + operator, character, norm sigma_xz -1 2.108379e-16 + operator, character, norm sigma_yz -1 2.575528e-16 + irrep b1g + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) 1 2.894955e-16 + operator, character, norm C_2(y) -1 3.059930e-16 + operator, character, norm C_2(x) -1 2.820691e-16 + operator, character, norm inversion 1 3.386283e-16 + operator, character, norm sigma_xy 1 2.425163e-16 + operator, character, norm sigma_xz -1 2.124835e-16 + operator, character, norm sigma_yz -1 2.562957e-16 + irrep b1u + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) 1 2.870570e-16 + operator, character, norm C_2(y) -1 2.682686e-16 + operator, character, norm C_2(x) -1 2.798381e-16 + operator, character, norm inversion -1 3.129936e-16 + operator, character, norm sigma_xy -1 1.969029e-16 + operator, character, norm sigma_xz 1 2.397942e-16 + operator, character, norm sigma_yz 1 2.380155e-16 + irrep b2g + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) -1 2.594145e-16 + operator, character, norm C_2(y) 1 2.633829e-16 + operator, character, norm C_2(x) -1 2.638078e-16 + operator, character, norm inversion 1 3.023601e-16 + operator, character, norm sigma_xy -1 2.139971e-16 + operator, character, norm sigma_xz 1 2.095492e-16 + operator, character, norm sigma_yz -1 2.225854e-16 + irrep b2u + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) -1 3.156545e-16 + operator, character, norm C_2(y) 1 3.248113e-16 + operator, character, norm C_2(x) -1 2.882059e-16 + operator, character, norm inversion -1 3.491268e-16 + operator, character, norm sigma_xy 1 2.359339e-16 + operator, character, norm sigma_xz -1 2.400474e-16 + operator, character, norm sigma_yz 1 2.947311e-16 + irrep b3g + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) -1 3.085651e-16 + operator, character, norm C_2(y) -1 3.145232e-16 + operator, character, norm C_2(x) 1 2.837117e-16 + operator, character, norm inversion 1 3.585469e-16 + operator, character, norm sigma_xy -1 2.460759e-16 + operator, character, norm sigma_xz -1 2.462714e-16 + operator, character, norm sigma_yz 1 2.961680e-16 + irrep b3u + operator, character, norm identity 1 0.000000e+00 + operator, character, norm C_2(z) -1 2.622458e-16 + operator, character, norm C_2(y) -1 2.753597e-16 + operator, character, norm C_2(x) 1 2.656874e-16 + operator, character, norm inversion -1 3.029825e-16 + operator, character, norm sigma_xy 1 2.240609e-16 + operator, character, norm sigma_xz 1 2.019326e-16 + operator, character, norm sigma_yz -1 2.335727e-16 + .. all good +point group c1 +sym_equiv.size() 1 +sym_adapt.size() 1 +sirrep [a] +point group cs +final function irreps: [a', a''] +sym_equiv.size() 2 +final function irreps: [a', a''] +sym_adapt.size() 2 +sirrep [a', a''] +point group c2 +final function irreps: [a, b] +sym_equiv.size() 2 +final function irreps: [a, b] +sym_adapt.size() 2 +sirrep [a, b] +point group ci +final function irreps: [ag, au] +sym_equiv.size() 2 +final function irreps: [ag, au] +sym_adapt.size() 2 +sirrep [ag, au] +point group c2v +final function irreps: [a1, a2, b1, b2] +sym_equiv.size() 4 +final function irreps: [a1, b2, a2, b1] +sym_adapt.size() 4 +sirrep [a1, b2, a2, b1] +point group c2h +final function irreps: [ag, bg, au, bu] +sym_equiv.size() 4 +final function irreps: [ag, bu, bg, au] +sym_adapt.size() 4 +sirrep [ag, bu, bg, au] +point group d2 +final function irreps: [a1, b1, b2, b3] +sym_equiv.size() 4 +final function irreps: [a1, b1, b3, b2] +sym_adapt.size() 4 +sirrep [a1, b1, b3, b2] +point group d2h +final function irreps: [ag, au, b1g, b1u, b2g, b2u, b3g, b3u] +sym_equiv.size() 8 +final function irreps: [ag, b3u, b3g, au, b1u, b2g, b2u, b1g] +sym_adapt.size() 8 +sirrep [ag, b3u, b3g, au, b1u, b2g, b2u, b1g] + .. all good +result 0 +MADNESS runtime finalized but 1 world still exists + test 53 Start 53: chem-test_masks_and_boxes 53: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem/test_masks_and_boxes 53: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem 53: Test timeout computed to be: 1500 -53: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +53: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 53: 53: test masks_and_boxes 53: -53: starting at time 0.0 +53: starting at time 0.1 53: deviation, tightness, r, maxed(r) 1.000000e-03 3.058998e+01 8.000000e+00 7.999281e+00 7.193347e-04 53: entering test_spherical_box -53: sbox with deviation 1e.-2 at time 6.9s: norm/tree/real/size: 110.65827 29769, 0.022, 0.099 GByte +53: sbox with deviation 1e.-2 at time 10.1s: norm/tree/real/size: 110.65827 29769, 0.022, 0.099 GByte 53: deviation, actual, expect,error 1.000000e-02 9.999998e-01 9.900000e-01 9.999764e-03 -53/56 Test #53: chem-test_masks_and_boxes ............... Passed 7.39 sec +53/56 Test #53: chem-test_masks_and_boxes ...............***Timeout 1500.39 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 + + test masks_and_boxes + +starting at time 0.1 +deviation, tightness, r, maxed(r) 1.000000e-03 3.058998e+01 8.000000e+00 7.999281e+00 7.193347e-04 +entering test_spherical_box + sbox with deviation 1e.-2 at time 10.1s: norm/tree/real/size: 110.65827 29769, 0.022, 0.099 GByte +deviation, actual, expect,error 1.000000e-02 9.999998e-01 9.900000e-01 9.999764e-03 + test 54 Start 54: chem-test_QCCalculationParametersBase 54: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem/test_QCCalculationParametersBase 54: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem 54: Test timeout computed to be: 1500 -54: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +54: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 54: defined parameters 54: econv 1.0000e-04 # defined recommended values: 1.e-4 < econv < 1.e-8 54: dconv 1.0000e-04 # defined recommended values: 1.e-4 < econv < 1.e-8 @@ -10083,17 +13128,71 @@ 54: entering test_empty_lines 54: entering test_derived 54: -54: finished at time 2.0s +54: finished at time 3.8s 54: 54: MADNESS runtime finalized but 1 world still exists -54/56 Test #54: chem-test_QCCalculationParametersBase ... Passed 2.11 sec +54/56 Test #54: chem-test_QCCalculationParametersBase ...***Timeout 1500.30 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 +defined parameters + econv 1.0000e-04 # defined recommended values: 1.e-4 < econv < 1.e-8 + dconv 1.0000e-04 # defined recommended values: 1.e-4 < econv < 1.e-8 + maxiter 12 # defined + localize true # default + local boys # default localization method [boys, pm, canon] + proto [1.0000e+00, 2.0000e+00] # default + ncf (slater,1.2000e+00) # defined + +foot + + +default parameters + econv 1.0000e-05 # default recommended values: 1.e-4 < econv < 1.e-8 + dconv 3.0000e-04 # default recommended values: 1.e-4 < econv < 1.e-8 + maxiter 15 # default + localize true # default + local boys # default localization method [boys, pm, canon] + proto [1.0000e+00, 2.0000e+00] # default + ncf (slater,2.0000e+00) # default + +foot + + +serialized parameters + econv 1.0000e-04 # defined recommended values: 1.e-4 < econv < 1.e-8 + dconv 1.0000e-04 # defined recommended values: 1.e-4 < econv < 1.e-8 + maxiter 12 # defined + localize true # default + local boys # default localization method [boys, pm, canon] + proto [1.0000e+00, 2.0000e+00] # default + ncf (slater,1.2000e+00) # defined + +foot + + +entering test_type_conversion1 +entering test_type_conversion2 +entering test_type_conversion3 +entering test_type_conversion5 +entering test_type_conversion6 +entering test_type_conversion7 +entering test_type_conversion8 +entering test_capitalization +entering test_not_allowed +entering test_commentlines +entering test_empty_lines +entering test_derived + +finished at time 3.8s + +MADNESS runtime finalized but 1 world still exists + test 55 Start 55: chem-test_qc 55: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem/test_qc 55: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem 55: Test timeout computed to be: 1500 -55: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +55: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 55: save false # defined if true save orbitals to disk 55: print_level 1 # defined 0: no output; 1: final energy; 2: iterations; 3: timings; 10: debug 55: @@ -10107,14 +13206,29 @@ 55: print_level 1 # defined 0: no output; 1: final energy; 2: iterations; 3: timings; 10: debug 55: 55: energy(LiH) -7.696558e+00 -55/56 Test #55: chem-test_qc ............................ Passed 116.16 sec +55/56 Test #55: chem-test_qc ............................***Timeout 1500.64 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 + save false # defined if true save orbitals to disk + print_level 1 # defined 0: no output; 1: final energy; 2: iterations; 3: timings; 10: debug + +energy(LiH) -7.703837e+00 +energy, hard-wire, diff -7.703837e+00 7.703833e+00 -3.767389e-06 +make all single variations for econv +made 1 singles permutations + econv 1.0000e-04 # defined energy convergence + maxiter 1 # defined maximum number of iterations + save false # defined if true save orbitals to disk + print_level 1 # defined 0: no output; 1: final energy; 2: iterations; 3: timings; 10: debug + +energy(LiH) -7.696558e+00 + test 56 Start 56: chem-test_MolecularOrbitals 56: Test command: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem/test_MolecularOrbitals 56: Working Directory: /build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu/src/apps/chem 56: Test timeout computed to be: 1500 -56: MADNESS runtime initialized with 63 threads in the pool and affinity -1 -1 -1 +56: MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 56: 56: Construct XC Functional from LIBXC Library 56: @@ -10129,40 +13243,40 @@ 56: 56: Solving NDIM= 3 with thresh 1.000000e-04 k 6 conv 1.000000e-04 56: -56: timer: Project vnuclear 0.40s 0.40s -56: timer: guess density 0.13s 0.13s -56: timer: guess Coulomb potn -187716.83s 1.23s -56: timer: guess lda potn 0.30s 0.32s -56: timer: guess overlap 0.13s 0.14s -56: timer: KEmat reconstruct 0.02s 0.03s -56: timer: KEmat differentiate 1.11s 1.19s -56: timer: KEmat compress 0.19s 0.21s -56: timer: KEmat inner products 0.45s 0.49s -56: timer: guess Kinet potn 1.80s 1.93s -56: timer: guess fock 0.49s 0.53s +56: timer: Project vnuclear 0.83s 0.83s +56: timer: guess density 0.22s 0.22s +56: timer: guess Coulomb potn 2.51s 2.51s +56: timer: guess lda potn 0.41s 0.41s +56: timer: guess overlap 0.07s 0.07s +56: timer: KEmat reconstruct 0.06s 0.06s +56: timer: KEmat differentiate 0.64s 0.64s +56: timer: KEmat compress 0.25s 0.25s +56: timer: KEmat inner products 0.35s 0.35s +56: timer: guess Kinet potn 1.32s 1.32s +56: timer: guess fock 0.70s 0.70s 56: timer: guess eigen sol 0.00s 0.00s -56: timer: guess orbital groupi 0.09s 0.10s +56: timer: guess orbital groupi 0.14s 0.14s 56: 56: Solving NDIM= 3 with thresh 1.000000e-04 k 6 conv 1.000000e-04 56: -56: timer: Project vnuclear 0.33s 0.36s +56: timer: Project vnuclear 0.55s 0.55s 56: -56: Iteration 0 at time 11.0s +56: Iteration 0 at time 14.4s 56: -56: timer: Pipek-Mezy new 0.07s 0.07s -56: timer: Make densities 0.07s 0.08s +56: timer: Pipek-Mezy new 0.09s 0.09s +56: timer: Make densities 0.15s 0.15s 56: timer: Load balancing 0.00s 0.00s -56: timer: Nuclear energy 0.05s 0.05s -56: timer: Coulomb 0.90s 0.97s -56: timer: V*psi 0.08s 0.09s -56: timer: HF exchange 1.72s 1.86s -56: timer: Truncate Vpsi 0.03s 0.03s -56: timer: PE matrix 0.07s 0.08s -56: timer: KEmat reconstruct 0.02s 0.02s -56: timer: KEmat differentiate 0.34s 0.37s -56: timer: KEmat compress 0.03s 0.04s -56: timer: KEmat inner products 0.25s 0.27s -56: timer: KE matrix 0.65s 0.70s +56: timer: Nuclear energy 0.08s 0.08s +56: timer: Coulomb 1.53s 1.53s +56: timer: V*psi 0.18s 0.18s +56: timer: HF exchange 2.85s 2.85s +56: timer: Truncate Vpsi 0.04s 0.04s +56: timer: PE matrix 0.08s 0.08s +56: timer: KEmat reconstruct 0.10s 0.10s +56: timer: KEmat differentiate 0.16s 0.16s +56: timer: KEmat compress 0.05s 0.05s +56: timer: KEmat inner products 0.20s 0.20s +56: timer: KE matrix 0.52s 0.52s 56: timer: Make fock matrix res 0.00s 0.00s 56: 56: kinetic 9.00436527 @@ -10174,34 +13288,34 @@ 56: nuclear-repulsion 2.08695652 56: total -7.64479540 56: -56: timer: Compute residual stu 0.04s 0.04s -56: timer: Apply BSH 0.49s 0.52s -56: timer: Truncate new psi 0.06s 0.07s +56: timer: Compute residual stu 0.08s 0.08s +56: timer: Apply BSH 0.89s 0.89s +56: timer: Truncate new psi 0.15s 0.15s 56: residuals [1.852805e-02, 1.557243e-01] 56: BSH residual: rms 1.108903e-01 max 1.557243e-01 -56: timer: BSH residual 0.04s 0.05s -56: timer: Update subspace stuf 0.08s 0.08s -56: timer: Subspace transform 0.03s 0.03s +56: timer: BSH residual 0.12s 0.12s +56: timer: Update subspace stuf 0.12s 0.12s +56: timer: Subspace transform 0.00s 0.00s 56: Norm of vector changes alpha : rms 1.108903e-01 max 1.557243e-01 -56: timer: Orthonormalize 0.25s 0.27s +56: timer: Orthonormalize 0.39s 0.39s 56: -56: Iteration 1 at time 16.5s +56: Iteration 1 at time 22.4s 56: -56: timer: Pipek-Mezy new 0.10s 0.11s -56: timer: Make densities 0.08s 0.09s +56: timer: Pipek-Mezy new 0.11s 0.11s +56: timer: Make densities 0.15s 0.15s 56: timer: Load balancing 0.00s 0.00s 56: delta rho 4.250193e-02 4.250193e-02 residuals 1.557243e-01 0.000000e+00 -56: timer: Nuclear energy 0.05s 0.06s -56: timer: Coulomb 0.79s 0.85s -56: timer: V*psi 0.09s 0.10s -56: timer: HF exchange 1.40s 1.50s -56: timer: Truncate Vpsi 0.03s 0.03s -56: timer: PE matrix 0.07s 0.08s -56: timer: KEmat reconstruct 0.03s 0.03s -56: timer: KEmat differentiate 0.46s 0.50s -56: timer: KEmat compress 0.03s 0.03s -56: timer: KEmat inner products 0.25s 0.27s -56: timer: KE matrix 0.77s 0.83s +56: timer: Nuclear energy 0.06s 0.06s +56: timer: Coulomb 1.48s 1.48s +56: timer: V*psi 0.33s 0.33s +56: timer: HF exchange 3.28s 3.28s +56: timer: Truncate Vpsi 0.06s 0.06s +56: timer: PE matrix 0.09s 0.09s +56: timer: KEmat reconstruct 0.05s 0.05s +56: timer: KEmat differentiate 0.18s 0.18s +56: timer: KEmat compress 0.35s 0.35s +56: timer: KEmat inner products 0.27s 0.27s +56: timer: KE matrix 0.86s 0.86s 56: timer: Make fock matrix res 0.00s 0.00s 56: 56: kinetic 8.68594569 @@ -10213,7 +13327,7 @@ 56: nuclear-repulsion 2.08695652 56: total -7.69515189 56: -56: timer: Overlap 0.09s 0.10s +56: timer: Overlap 0.18s 0.18s 56: timer: focka eigen sol 0.00s 0.00s 56: 56: alpha eigenvalues @@ -10223,16 +13337,16 @@ 56: Dipole Moment (a.u.) 56: ----------- 56: -56: x: 6.960894e-12 -56: y: 6.955212e-12 +56: x: 6.961101e-12 +56: y: 6.942081e-12 56: z: -1.945799e+00 56: Total Dipole Moment: 1.945799e+00 56: -56: timer: dipole 0.02s 0.03s +56: timer: dipole 0.06s 0.06s 56: Orbitals are localized - energies are diagonal Fock matrix elements 56: 56: Analysis of alpha MO vectors -56: timer: Analyze vectors 1.03s 1.11s +56: timer: Analyze vectors 1.95s 1.95s 56: timer: Compute eigen gesv a 0.00s 0.00s 56: MO 0 : occ=1.00 : energy= -2.44294955 : ncoeff=1.19e+05:center=(-0.00,-0.00,-0.37) : radius=0.70 56: Li(0) s( 0)-1.017 @@ -10257,40 +13371,40 @@ 56: 56: Solving NDIM= 3 with thresh 1.000000e-04 k 6 conv 1.000000e-04 56: -56: timer: Project vnuclear 0.34s 0.36s -56: timer: guess density 0.13s 0.14s -56: timer: guess Coulomb potn 1.52s 1.63s -56: timer: guess lda potn 0.27s 0.29s -56: timer: guess overlap -187719.36s 0.12s -56: timer: KEmat reconstruct 0.04s 0.04s -56: timer: KEmat differentiate 187721.28s 1.80s -56: timer: KEmat compress -187719.54s 0.08s -56: timer: KEmat inner products 0.31s 0.34s -56: timer: guess Kinet potn 2.11s 2.27s -56: timer: guess fock 0.36s 0.39s +56: timer: Project vnuclear 0.78s 0.78s +56: timer: guess density 0.19s 0.19s +56: timer: guess Coulomb potn 2.37s 2.37s +56: timer: guess lda potn 0.35s 0.35s +56: timer: guess overlap 0.10s 0.10s +56: timer: KEmat reconstruct 0.07s 0.07s +56: timer: KEmat differentiate 0.60s 0.60s +56: timer: KEmat compress 0.30s 0.30s +56: timer: KEmat inner products 0.33s 0.33s +56: timer: guess Kinet potn 1.33s 1.33s +56: timer: guess fock 0.80s 0.80s 56: timer: guess eigen sol 0.00s 0.00s -56: timer: guess orbital groupi 0.09s 0.09s +56: timer: guess orbital groupi 0.15s 0.15s 56: 56: Solving NDIM= 3 with thresh 1.000000e-03 k 6 conv 1.000000e-03 56: -56: timer: Project vnuclear 0.21s 0.22s +56: timer: Project vnuclear 0.67s 0.67s 56: -56: Iteration 0 at time 30.5s +56: Iteration 0 at time 43.4s 56: -56: timer: Pipek-Mezy new 0.06s 0.07s -56: timer: Make densities 0.06s 0.06s +56: timer: Pipek-Mezy new 0.09s 0.09s +56: timer: Make densities 0.12s 0.12s 56: timer: Load balancing 0.00s 0.00s -56: timer: Nuclear energy 0.03s 0.03s -56: timer: Coulomb 0.45s 0.48s -56: timer: V*psi 0.07s 0.08s -56: timer: HF exchange 1.16s 1.25s -56: timer: Truncate Vpsi 0.02s 0.02s -56: timer: PE matrix 0.04s 0.05s -56: timer: KEmat reconstruct 0.02s 0.02s -56: timer: KEmat differentiate 0.28s 0.30s -56: timer: KEmat compress 0.03s 0.03s -56: timer: KEmat inner products 0.26s 0.27s -56: timer: KE matrix 0.59s 0.64s +56: timer: Nuclear energy 0.08s 0.08s +56: timer: Coulomb 0.70s 0.70s +56: timer: V*psi 0.14s 0.14s +56: timer: HF exchange 2.07s 2.07s +56: timer: Truncate Vpsi 0.04s 0.04s +56: timer: PE matrix 0.05s 0.05s +56: timer: KEmat reconstruct 0.05s 0.05s +56: timer: KEmat differentiate 0.11s 0.11s +56: timer: KEmat compress 0.14s 0.14s +56: timer: KEmat inner products 0.18s 0.18s +56: timer: KE matrix 0.49s 0.49s 56: timer: Make fock matrix res 0.00s 0.00s 56: 56: kinetic 9.00698174 @@ -10302,34 +13416,34 @@ 56: nuclear-repulsion 2.08695652 56: total -7.63739591 56: -56: timer: Compute residual stu 0.06s 0.06s -56: timer: Apply BSH 0.37s 0.40s -56: timer: Truncate new psi 0.06s 0.06s +56: timer: Compute residual stu 0.05s 0.05s +56: timer: Apply BSH 0.57s 0.57s +56: timer: Truncate new psi 0.09s 0.09s 56: residuals [1.876331e-02, 1.575521e-01] 56: BSH residual: rms 1.121934e-01 max 1.575521e-01 -56: timer: BSH residual 0.07s 0.07s -56: timer: Update subspace stuf 0.05s 0.05s -56: timer: Subspace transform 0.02s 0.02s +56: timer: BSH residual 0.08s 0.08s +56: timer: Update subspace stuf 0.12s 0.12s +56: timer: Subspace transform 0.00s 0.00s 56: Norm of vector changes alpha : rms 1.121934e-01 max 1.575521e-01 -56: timer: Orthonormalize 0.21s 0.22s +56: timer: Orthonormalize 0.24s 0.24s 56: -56: Iteration 1 at time 34.4s +56: Iteration 1 at time 48.9s 56: -56: timer: Pipek-Mezy new 0.06s 0.07s -56: timer: Make densities 0.05s 0.06s +56: timer: Pipek-Mezy new 0.15s 0.15s +56: timer: Make densities 0.09s 0.09s 56: timer: Load balancing 0.00s 0.00s 56: delta rho 4.288859e-02 4.288859e-02 residuals 1.575521e-01 0.000000e+00 -56: timer: Nuclear energy 0.03s 0.04s -56: timer: Coulomb 0.39s 0.42s -56: timer: V*psi 0.06s 0.06s -56: timer: HF exchange 1.13s 1.22s +56: timer: Nuclear energy 0.05s 0.05s +56: timer: Coulomb 0.68s 0.68s +56: timer: V*psi 0.18s 0.18s +56: timer: HF exchange 2.05s 2.05s 56: timer: Truncate Vpsi 0.03s 0.03s -56: timer: PE matrix 0.06s 0.06s -56: timer: KEmat reconstruct 0.02s 0.02s -56: timer: KEmat differentiate 0.39s 0.42s -56: timer: KEmat compress 0.03s 0.03s -56: timer: KEmat inner products 0.21s 0.22s -56: timer: KE matrix 0.64s 0.69s +56: timer: PE matrix 0.07s 0.07s +56: timer: KEmat reconstruct 0.05s 0.05s +56: timer: KEmat differentiate 0.14s 0.14s +56: timer: KEmat compress 0.06s 0.06s +56: timer: KEmat inner products 0.19s 0.19s +56: timer: KE matrix 0.45s 0.45s 56: timer: Make fock matrix res 0.00s 0.00s 56: 56: kinetic 8.68200342 @@ -10341,7 +13455,7 @@ 56: nuclear-repulsion 2.08695652 56: total -7.68823635 56: -56: timer: Overlap 0.05s 0.06s +56: timer: Overlap 0.09s 0.09s 56: timer: focka eigen sol 0.00s 0.00s 56: 56: alpha eigenvalues @@ -10351,17 +13465,17 @@ 56: Dipole Moment (a.u.) 56: ----------- 56: -56: x: 7.680882e-12 -56: y: 7.689658e-12 +56: x: 7.690476e-12 +56: y: 7.684698e-12 56: z: -1.947957e+00 56: Total Dipole Moment: 1.947957e+00 56: -56: timer: dipole 0.02s 0.02s +56: timer: dipole 0.05s 0.05s 56: Orbitals are localized - energies are diagonal Fock matrix elements 56: 56: Analysis of alpha MO vectors -56: timer: Analyze vectors 0.93s 1.01s -56: timer: Compute eigen gesv a 0.00s 0.00s +56: timer: Analyze vectors 1.79s 1.79s +56: timer: Compute eigen gesv a 0.02s 0.02s 56: MO 0 : occ=1.00 : energy= -2.44194449 : ncoeff=8.47e+04:center=(-0.00,-0.00,-0.37) : radius=0.70 56: Li(0) s( 0)-1.017 56: total number of coefficients = 8.46720000e+04 @@ -10372,16 +13486,307 @@ 56: 56: reading from aobasis STO-3G 56: result 0 -56/56 Test #56: chem-test_MolecularOrbitals ............. Passed 40.74 sec +56/56 Test #56: chem-test_MolecularOrbitals .............***Timeout 1500.25 sec +MADNESS runtime initialized with 127 threads in the pool and affinity -1 -1 -1 + +Construct XC Functional from LIBXC Library + +input line was: hf + 1.000 HF exchange + +screening parameters + rhotol, rhomin 1.000000e-07 0.000000e+00 + ggatol 1.000000e-04 +polarized false + + +Solving NDIM= 3 with thresh 1.000000e-04 k 6 conv 1.000000e-04 + +timer: Project vnuclear 0.83s 0.83s +timer: guess density 0.22s 0.22s +timer: guess Coulomb potn 2.51s 2.51s +timer: guess lda potn 0.41s 0.41s +timer: guess overlap 0.07s 0.07s +timer: KEmat reconstruct 0.06s 0.06s +timer: KEmat differentiate 0.64s 0.64s +timer: KEmat compress 0.25s 0.25s +timer: KEmat inner products 0.35s 0.35s +timer: guess Kinet potn 1.32s 1.32s +timer: guess fock 0.70s 0.70s +timer: guess eigen sol 0.00s 0.00s +timer: guess orbital groupi 0.14s 0.14s + +Solving NDIM= 3 with thresh 1.000000e-04 k 6 conv 1.000000e-04 + +timer: Project vnuclear 0.55s 0.55s + +Iteration 0 at time 14.4s + +timer: Pipek-Mezy new 0.09s 0.09s +timer: Make densities 0.15s 0.15s +timer: Load balancing 0.00s 0.00s +timer: Nuclear energy 0.08s 0.08s +timer: Coulomb 1.53s 1.53s +timer: V*psi 0.18s 0.18s +timer: HF exchange 2.85s 2.85s +timer: Truncate Vpsi 0.04s 0.04s +timer: PE matrix 0.08s 0.08s +timer: KEmat reconstruct 0.10s 0.10s +timer: KEmat differentiate 0.16s 0.16s +timer: KEmat compress 0.05s 0.05s +timer: KEmat inner products 0.20s 0.20s +timer: KE matrix 0.52s 0.52s +timer: Make fock matrix res 0.00s 0.00s + + kinetic 9.00436527 + nonlocal psp 0.00000000 + nuclear attraction -23.09347407 + coulomb 6.68865427 + PCM 0.00000000 + exchange-correlation -2.33129740 + nuclear-repulsion 2.08695652 + total -7.64479540 + +timer: Compute residual stu 0.08s 0.08s +timer: Apply BSH 0.89s 0.89s +timer: Truncate new psi 0.15s 0.15s +residuals [1.852805e-02, 1.557243e-01] +BSH residual: rms 1.108903e-01 max 1.557243e-01 +timer: BSH residual 0.12s 0.12s +timer: Update subspace stuf 0.12s 0.12s +timer: Subspace transform 0.00s 0.00s +Norm of vector changes alpha : rms 1.108903e-01 max 1.557243e-01 +timer: Orthonormalize 0.39s 0.39s + +Iteration 1 at time 22.4s + +timer: Pipek-Mezy new 0.11s 0.11s +timer: Make densities 0.15s 0.15s +timer: Load balancing 0.00s 0.00s +delta rho 4.250193e-02 4.250193e-02 residuals 1.557243e-01 0.000000e+00 +timer: Nuclear energy 0.06s 0.06s +timer: Coulomb 1.48s 1.48s +timer: V*psi 0.33s 0.33s +timer: HF exchange 3.28s 3.28s +timer: Truncate Vpsi 0.06s 0.06s +timer: PE matrix 0.09s 0.09s +timer: KEmat reconstruct 0.05s 0.05s +timer: KEmat differentiate 0.18s 0.18s +timer: KEmat compress 0.35s 0.35s +timer: KEmat inner products 0.27s 0.27s +timer: KE matrix 0.86s 0.86s +timer: Make fock matrix res 0.00s 0.00s + + kinetic 8.68594569 + nonlocal psp 0.00000000 + nuclear attraction -22.66386176 + coulomb 6.46274657 + PCM 0.00000000 + exchange-correlation -2.26693892 + nuclear-repulsion 2.08695652 + total -7.69515189 + +timer: Overlap 0.18s 0.18s +timer: focka eigen sol 0.00s 0.00s + +alpha eigenvalues +[*] -2.49312591 -0.30002960 + + + Dipole Moment (a.u.) + ----------- + + x: 6.961101e-12 + y: 6.942081e-12 + z: -1.945799e+00 + Total Dipole Moment: 1.945799e+00 + +timer: dipole 0.06s 0.06s +Orbitals are localized - energies are diagonal Fock matrix elements + +Analysis of alpha MO vectors +timer: Analyze vectors 1.95s 1.95s +timer: Compute eigen gesv a 0.00s 0.00s + MO 0 : occ=1.00 : energy= -2.44294955 : ncoeff=1.19e+05:center=(-0.00,-0.00,-0.37) : radius=0.70 + Li(0) s( 0)-1.017 +total number of coefficients = 1.19232000e+05 + + MO 1 : occ=1.00 : energy= -0.35020438 : ncoeff=9.85e+04:center=(-0.00,-0.00,1.35) : radius=2.01 + H(1) s( 5) 0.613 Li(0) pz( 4) 0.365 Li(0) s( 1) 0.328 Li(0) s( 0)-0.191 +total number of coefficients = 2.17728000e+05 + +errors 0.000000e+00 0.000000e+00 0.000000e+00 0.000000e+00 + +Construct XC Functional from LIBXC Library + +input line was: hf + 1.000 HF exchange + +screening parameters + rhotol, rhomin 1.000000e-07 0.000000e+00 + ggatol 1.000000e-04 +polarized false + + +Solving NDIM= 3 with thresh 1.000000e-04 k 6 conv 1.000000e-04 + +timer: Project vnuclear 0.78s 0.78s +timer: guess density 0.19s 0.19s +timer: guess Coulomb potn 2.37s 2.37s +timer: guess lda potn 0.35s 0.35s +timer: guess overlap 0.10s 0.10s +timer: KEmat reconstruct 0.07s 0.07s +timer: KEmat differentiate 0.60s 0.60s +timer: KEmat compress 0.30s 0.30s +timer: KEmat inner products 0.33s 0.33s +timer: guess Kinet potn 1.33s 1.33s +timer: guess fock 0.80s 0.80s +timer: guess eigen sol 0.00s 0.00s +timer: guess orbital groupi 0.15s 0.15s + +Solving NDIM= 3 with thresh 1.000000e-03 k 6 conv 1.000000e-03 + +timer: Project vnuclear 0.67s 0.67s + +Iteration 0 at time 43.4s + +timer: Pipek-Mezy new 0.09s 0.09s +timer: Make densities 0.12s 0.12s +timer: Load balancing 0.00s 0.00s +timer: Nuclear energy 0.08s 0.08s +timer: Coulomb 0.70s 0.70s +timer: V*psi 0.14s 0.14s +timer: HF exchange 2.07s 2.07s +timer: Truncate Vpsi 0.04s 0.04s +timer: PE matrix 0.05s 0.05s +timer: KEmat reconstruct 0.05s 0.05s +timer: KEmat differentiate 0.11s 0.11s +timer: KEmat compress 0.14s 0.14s +timer: KEmat inner products 0.18s 0.18s +timer: KE matrix 0.49s 0.49s +timer: Make fock matrix res 0.00s 0.00s + + kinetic 9.00698174 + nonlocal psp 0.00000000 + nuclear attraction -23.08870737 + coulomb 6.68864456 + PCM 0.00000000 + exchange-correlation -2.33127137 + nuclear-repulsion 2.08695652 + total -7.63739591 + +timer: Compute residual stu 0.05s 0.05s +timer: Apply BSH 0.57s 0.57s +timer: Truncate new psi 0.09s 0.09s +residuals [1.876331e-02, 1.575521e-01] +BSH residual: rms 1.121934e-01 max 1.575521e-01 +timer: BSH residual 0.08s 0.08s +timer: Update subspace stuf 0.12s 0.12s +timer: Subspace transform 0.00s 0.00s +Norm of vector changes alpha : rms 1.121934e-01 max 1.575521e-01 +timer: Orthonormalize 0.24s 0.24s + +Iteration 1 at time 48.9s + +timer: Pipek-Mezy new 0.15s 0.15s +timer: Make densities 0.09s 0.09s +timer: Load balancing 0.00s 0.00s +delta rho 4.288859e-02 4.288859e-02 residuals 1.575521e-01 0.000000e+00 +timer: Nuclear energy 0.05s 0.05s +timer: Coulomb 0.68s 0.68s +timer: V*psi 0.18s 0.18s +timer: HF exchange 2.05s 2.05s +timer: Truncate Vpsi 0.03s 0.03s +timer: PE matrix 0.07s 0.07s +timer: KEmat reconstruct 0.05s 0.05s +timer: KEmat differentiate 0.14s 0.14s +timer: KEmat compress 0.06s 0.06s +timer: KEmat inner products 0.19s 0.19s +timer: KE matrix 0.45s 0.45s +timer: Make fock matrix res 0.00s 0.00s + + kinetic 8.68200342 + nonlocal psp 0.00000000 + nuclear attraction -22.65060635 + coulomb 6.45920160 + PCM 0.00000000 + exchange-correlation -2.26579154 + nuclear-repulsion 2.08695652 + total -7.68823635 + +timer: Overlap 0.09s 0.09s +timer: focka eigen sol 0.00s 0.00s + +alpha eigenvalues +[*] -2.49171330 -0.29970479 + + + Dipole Moment (a.u.) + ----------- + + x: 7.690476e-12 + y: 7.684698e-12 + z: -1.947957e+00 + Total Dipole Moment: 1.947957e+00 + +timer: dipole 0.05s 0.05s +Orbitals are localized - energies are diagonal Fock matrix elements + +Analysis of alpha MO vectors +timer: Analyze vectors 1.79s 1.79s +timer: Compute eigen gesv a 0.02s 0.02s + MO 0 : occ=1.00 : energy= -2.44194449 : ncoeff=8.47e+04:center=(-0.00,-0.00,-0.37) : radius=0.70 + Li(0) s( 0)-1.017 +total number of coefficients = 8.46720000e+04 + + MO 1 : occ=1.00 : energy= -0.34947112 : ncoeff=8.47e+04:center=(-0.00,-0.00,1.35) : radius=2.01 + H(1) s( 5) 0.612 Li(0) pz( 4) 0.365 Li(0) s( 1) 0.329 Li(0) s( 0)-0.191 +total number of coefficients = 1.69344000e+05 + +reading from aobasis STO-3G +result 0 + -95% tests passed, 3 tests failed out of 56 +38% tests passed, 35 tests failed out of 56 -Total Test time (real) = 3239.14 sec +Total Test time (real) = 56286.41 sec The following tests FAILED: - 45 - mra-testvmra (SEGFAULT) - 47 - mra_sepop-testsuite (Failed) - 50 - chem-test_SCFOperators (Subprocess aborted) + 2 - world-test_prof (Timeout) + 3 - world-test_ar (Timeout) + 4 - world-test_hashdc (Timeout) + 5 - world-test_hello (Timeout) + 6 - world-test_atomicint (Timeout) + 7 - world-test_future (Timeout) + 8 - world-test_future2 (Timeout) + 10 - world-test_dc (Timeout) + 11 - world-test_hashthreaded (Timeout) + 12 - world-test_queue (Timeout) + 13 - world-test_world (Timeout) + 14 - world-test_worldprofile (Timeout) + 15 - world-test_binsorter (Timeout) + 18 - world-test_worldref (Timeout) + 20 - world-test_googletest (Timeout) + 21 - world-test_tree (Timeout) + 29 - tensor-test_distributed_matrix (Timeout) + 31 - tensor-test_systolic (Timeout) + 37 - mra-testbsh (Timeout) + 38 - mra-testproj (Timeout) + 39 - mra-testpdiff (Timeout) + 40 - mra-testdiff1Db (Timeout) + 41 - mra-testgconv (Timeout) + 42 - mra-testopdir (Timeout) + 43 - mra-testinnerext (Timeout) + 44 - mra-testgaxpyext (Timeout) + 45 - mra-testvmra (Timeout) + 47 - mra_sepop-testsuite (Timeout) + 50 - chem-test_SCFOperators (Timeout) + 51 - chem-test_dft (Timeout) + 52 - chem-test_pointgroupsymmetry (Timeout) + 53 - chem-test_masks_and_boxes (Timeout) + 54 - chem-test_QCCalculationParametersBase (Timeout) + 55 - chem-test_qc (Timeout) + 56 - chem-test_MolecularOrbitals (Timeout) Errors while running CTest make[2]: *** [Makefile:74: test] Error 8 make[2]: Leaving directory '/build/reproducible-path/madness-0.10.1+git20200818.eee5fd9f/obj-x86_64-linux-gnu' @@ -11100,12 +14505,14 @@ dpkg-buildpackage: info: binary-only upload (no source included) dpkg-genchanges: info: not including original source code in upload I: copying local configuration +I: user script /srv/workspace/pbuilder/3423284/tmp/hooks/B01_cleanup starting +I: user script /srv/workspace/pbuilder/3423284/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/2285845 and its subdirectories -I: Current time: Thu Jun 6 06:34:37 -12 2024 -I: pbuilder-time-stamp: 1717698877 +I: removing directory /srv/workspace/pbuilder/3423284 and its subdirectories +I: Current time: Fri Jul 11 06:51:12 +14 2025 +I: pbuilder-time-stamp: 1752166272